Known targets — ChEMBL curated mechanism
ABL1BMXBRAFBTKCHRNA4CHRNB2CSNK1EEGFRERBB2F10FLT1FLT3FLT4IGF1RINSRITKJAK3KDRKITOPRM1PARP1PARP2PDGFRBPIK3CDRAF1RETSLC18A2TECTXKdacAdacBdacCftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of P-Nitrophenol. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 2/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | PKM | P14618 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.49 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.49 |
| ▸ | CXCR5 | P32302 | 1/20 | 0.49 |
| ▸ | APLNR | P35414 | 1/20 | 0.49 |
| ▸ | CCR6 | P51684 | 1/20 | 0.49 |
| ▸ | GFER | P55789 | 1/20 | 0.49 |
| ▸ | BCHE | P06276 | 1/20 | 0.48 |
| ▸ | CYTH2 | Q99418 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 4/20 | 0.45 |
| ▸ | CA2 | P00918 | 4/20 | 0.45 |
| ▸ | CA12 | O43570 | 3/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL19272432 | 0.90 | ACHE (0.69) | ACHEHSD17B10PKMKMT2ARAB9A | |
| P-Cresol SCHEMBL27506994 | 0.85 | ACHE (0.78) | ACHEHSD17B10PKMKMT2AGFER | |
| P-Nitrophenol SCHEMBL3148668 | 0.85 | ACHE (0.78) | ACHEHSD17B10PKMKMT2AGFER | |
| 4-Nitrotoluene SCHEMBL6481181 | 0.84 | ACHE (0.60) | ACHEHSD17B10LMNAPKMKMT2A | |
| Hydroquinone SCHEMBL7614409 | 0.83 | LMNA (0.77) | ACHELMNACYTH2ALDH1A1GAA | |
| Phenolsulfonic Acid SCHEMBL21551817 | 0.83 | LMNA (0.77) | ACHELMNACYTH2ALDH1A1GAA | |
| P-Cresol SCHEMBL28898083 | 0.83 | LMNA (0.77) | ACHELMNACYTH2ALDH1A1GAA | |
| 4-Nitroaniline SCHEMBL8400816 | 0.83 | ALDH1A1 (0.58) | ACHEHSD17B10PKMKMT2ARAB9A | |
| 3-Nitro-Phenol SCHEMBL9470484 | 0.82 | TSHR (0.61) | ACHEHSD17B10LMNAKMT2ACYTH2 | |
| Nitrobenzene SCHEMBL660753 | 0.82 | ACHE (0.57) | ACHEHSD17B10LMNAPKMKMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5186865-A | Aminoazobenzene derivatives and polymers | ALLIED-SIGNAL INC. (US) | 1993-02-16 | — | — | US | disclosed |
| US-5061404-A | WAVEGUIDES | ALLIED-SIGNAL INC. (US) | 1991-10-29 | — | — | US | disclosed |
| WO-1991009842-A1 | ELECTRO-OPTICAL MATERIALS AND LIGHT MODULATOR DEVICES CONTAINING SAME | ALLIED-SIGNAL INC. (US) | 1991-07-11 | — | — | WO | disclosed |