Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 3/20 | 0.54 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.50 |
| ▸ | MAOB | P27338 | 3/20 | 0.47 |
| ▸ | AOC2 | O75106 | 2/20 | 0.47 |
| ▸ | MAOA | P21397 | 2/20 | 0.47 |
| ▸ | DAO | P14920 | 1/20 | 0.47 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | LTA4H | P09960 | 1/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.40 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.40 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.40 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL10477050 | 0.81 | AOC3 (0.61) | AOC3KCNA3MAOBAOC2MAOA | |
| SCHEMBL10477051 | 0.81 | AOC3 (0.61) | AOC3KCNA3MAOBAOC2MAOA | |
| SCHEMBL419306 | 0.79 | AOC3 (0.78) | AOC3KCNA3TAAR1ALDH1A1RECQL | |
| SCHEMBL1445312 | 0.79 | AOC3 (0.58) | AOC3KCNA3TAAR1ALDH1A1RECQL | |
| SCHEMBL419305 | 0.79 | AOC3 (0.78) | AOC3KCNA3TAAR1ALDH1A1RECQL | |
| SCHEMBL9486588 | 0.76 | KCNA3 (0.65) | KCNA3TAAR1ALDH1A1RECQLLTA4H | |
| SCHEMBL9486653 | 0.76 | KCNA3 (0.58) | KCNA3MAOBAOC2MAOADAO | |
| SCHEMBL5709101 | 0.75 | AOC3 (0.54) | AOC3KCNA3TAAR1ALDH1A1RECQL | |
| SCHEMBL8526568 | 0.75 | AOC3 (0.54) | AOC3KCNA3TAAR1ALDH1A1RECQL | |
| SCHEMBL4154296 | 0.75 | AOC3 (0.54) | AOC3KCNA3TAAR1ALDH1A1RECQL |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105037208-A | N-(1-methyl-2-substituted methyl) valine amide carbamate derivative and application | UNIV NANKAI | 2015-11-11 | — | — | CN | claimed |
| CN-104016886-A | N-1,2-disubstituted ethyl valinamide carbamate derivative and application thereof | UNIV NANKAI | 2014-09-03 | — | — | CN | claimed |
| WO-2016160938-A1 | N-(1,3-THIAZOL-2-YL)PYRIMIDINE-5-CARBOXAMIDES AS TRPV3 MODULATORS | ABBVIE INC. (US) | 2016-10-06 | — | — | WO | disclosed |
| CN-105037208-A | N-(1-methyl-2-substituted methyl) valine amide carbamate derivative and application | UNIV NANKAI | 2015-11-11 | — | — | CN | disclosed |
| CN-104016886-A | N-1,2-disubstituted ethyl valinamide carbamate derivative and application thereof | UNIV NANKAI | 2014-09-03 | — | — | CN | disclosed |
| EP-2178373-A1 | HETEROCYCLES AS POTASSIUM CHANNEL MODULATORS | Icagen, Inc. (US) | 2010-04-28 | — | — | EP | disclosed |
| WO-2009026254-A1 | HETEROCYCLES AS POTASSIUM CHANNEL MODULATORS | ICAGEN, INC. (US) | 2009-02-26 | — | — | WO | disclosed |
| US-5192767-A | Nonphytotoxic | BASF AKTIENGESELLSCHAFT (DE) | 1993-03-09 | — | — | US | disclosed |
| EP-0311907-A2 | 3-Substituted pyridines and fungicides containing them | BASF Aktiengesellschaft (DE) | 1989-04-19 | — | — | EP | disclosed |