Known targets — ChEMBL curated mechanism
ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of Nitroacetic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 5/20 | 0.47 |
| ▸ | CA4 | P22748 | 4/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | FFAR3 | O14843 | 2/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | BLM | P54132 | 1/20 | 0.33 |
| ▸ | HBB | P68871 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Nitroacetic Acid SCHEMBL724919 | 0.97 | CA1 (0.45) | CA1CA4TSHRFFAR3HDAC3 | |
| Nitroacetic Acid SCHEMBL11355336 | 0.95 | CA1 (0.42) | CA1CA4TSHRFFAR3HDAC3 | |
| Nitroacetic Acid SCHEMBL19995634 | 0.92 | CA4 (0.42) | CA1CA4TSHRFFAR3HDAC3 | |
| Nitroacetic Acid SCHEMBL6546218 | 0.92 | — | — | |
| Nitroacetic Acid SCHEMBL11577983 | 0.86 | — | — | |
| Nitroacetic Acid SCHEMBL11879474 | 0.86 | — | — | |
| Nitroacetic Acid SCHEMBL13859133 | 0.86 | MEN1 (0.38) | CA4TSHRFFAR3HDAC3HDAC1 | |
| Nitroacetic Acid SCHEMBL11626509 | 0.86 | MEN1 (0.38) | CA4TSHRFFAR3HDAC3HDAC1 | |
| Nitroacetic Acid SCHEMBL5933854 | 0.86 | — | — | |
| Nitroacetic Acid SCHEMBL5933850 | 0.86 | MEN1 (0.38) | CA4TSHRFFAR3HDAC3HDAC1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-2002818-A | — | — | None | — | — | JP | disclosed |
| CN-117203305-A | In situ methane production recovery from waste | 特兰斯沃尔德技术有限公司 | 2023-12-08 | — | — | CN | disclosed |
| CN-110799197-A | Use of calcium binders for preventing stillbirth | 纽崔克IP资产有限公司 | 2020-02-14 | — | — | CN | disclosed |
| EP-1011030-B1 | Photosensitive lithographic printing plate | FUJI PHOTO FILM CO LTD (JP) | 2002-04-17 | — | — | EP | disclosed |
| EP-1011030-A1 | Photosensitive lithographic printing plate | FUJI PHOTO FILM CO., LTD. (JP) | 2000-06-21 | — | — | EP | disclosed |
| EP-0461670-B1 | Composition and process for the processing of silver halide color photographic material | FUJI PHOTO FILM CO LTD (JP) | 1998-04-01 | — | — | EP | disclosed |
| US-5188927-A | Bleaching | FUJI PHOTO FILM CO., LTD. (JP) | 1993-02-23 | — | — | US | disclosed |
| EP-0461670-A1 | Composition and process for the processing of silver halide color photographic material | FUJI PHOTO FILM CO., LTD. (JP) | 1991-12-18 | — | — | EP | disclosed |
| JP-H022818-A | ABSORPTION OF HYDROGEN SULFIDE | PHILLIPS PETROLEUM CO | 1990-01-08 | — | — | JP | disclosed |
| EP-0343557-A2 | Processing method of silver halide photographic light-sensitive material | KONICA CORPORATION (JP) | 1989-11-29 | — | — | EP | disclosed |