Known targets — ChEMBL curated mechanism
ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of Ethyl Picolinate. 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 | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.57 |
| ▸ | POLB | P06746 | 1/20 | 0.57 |
| ▸ | MAPT | P10636 | 1/20 | 0.55 |
| ▸ | APP | P05067 | 1/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.54 |
| ▸ | PKM | P14618 | 2/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.52 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | NPC1 | O15118 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | CASP1 | P29466 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | MITF | O75030 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| Ethyl Picolinate SCHEMBL30016787 | 0.95 | CYP1A2 (0.65) | CYP1A2ALDH1A1POLBMAPTAPP | |
| Ethyl Picolinate SCHEMBL8661716 | 0.95 | CYP1A2 (0.65) | CYP1A2ALDH1A1POLBMAPTAPP | |
| Ethyl Picolinate SCHEMBL126181 | 0.95 | CYP1A2 (0.65) | CYP1A2ALDH1A1POLBMAPTAPP | |
| Ethyl Picolinate SCHEMBL27510221 | 0.93 | CYP1A2 (0.62) | CYP1A2ALDH1A1POLBMAPTAPP | |
| Ethyl Picolinate SCHEMBL28419537 | 0.93 | CYP1A2 (0.62) | CYP1A2ALDH1A1POLBMAPTAPP | |
| Ethyl Picolinate SCHEMBL27624408 | 0.93 | CYP1A2 (0.62) | CYP1A2ALDH1A1POLBMAPTAPP | |
| Ethyl Picolinate SCHEMBL29054125 | 0.93 | CYP1A2 (0.62) | CYP1A2ALDH1A1POLBMAPTAPP | |
| Ethyl Picolinate SCHEMBL10544568 | 0.89 | CYP1A2 (0.57) | CYP1A2ALDH1A1POLBMAPTAPP | |
| Ethyl Picolinate SCHEMBL27699751 | 0.89 | CYP1A2 (0.57) | CYP1A2ALDH1A1POLBMAPTAPP | |
| Ethyl Picolinate SCHEMBL6739951 | 0.84 | ALDH1A1 (0.53) | CYP1A2ALDH1A1POLBMAPTAPP |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116437947-A | Non-pig formulations and methods thereof | 第一浪潮生物制药有限公司 | 2023-07-14 | — | — | CN | claimed |
| CN-116437947-A | Non-pig formulations and methods thereof | 第一浪潮生物制药有限公司 | 2023-07-14 | — | — | CN | disclosed |
| CN-115697336-A | Pharmaceutical preparation and use thereof | 奥尔德拉医疗公司 | 2023-02-03 | — | — | CN | disclosed |
| CN-108440527-A | A kind of acidification corrosion inhibitor and the preparation method and application thereof based on mutual aggressiveness indole derivative | 中国石油大学(华东) | 2018-08-24 | — | — | CN | disclosed |