Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.52 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.50 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.47 |
| ▸ | HTR3B | O95264 | 1/20 | 0.47 |
| ▸ | HTR3A | P46098 | 1/20 | 0.47 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.47 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.47 |
| ▸ | MAOB | P27338 | 1/20 | 0.45 |
| ▸ | IDO1 | P14902 | 3/20 | 0.44 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | IGF1R | P08069 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | DPP4 | P27487 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL11062642 | 0.82 | TAAR1 (0.50) | TAAR1SLC6A4HTR3EHTR3BHTR3A | |
| SCHEMBL7956101 | 0.82 | TAAR1 (0.56) | TAAR1SLC6A4HTR3EHTR3BHTR3A | |
| SCHEMBL6823686 | 0.82 | TAAR1 (0.56) | TAAR1SLC6A4HTR3EHTR3BHTR3A | |
| SCHEMBL2371135 | 0.80 | GFER (0.56) | TAAR1HTR3ASLC6A2MAOBCYP2C19 | |
| SCHEMBL10869995 | 0.80 | ESR1 (0.56) | TAAR1HTR3ASLC6A2CYP2C19 | |
| SCHEMBL18704005 | 0.79 | SLC6A4 (0.52) | TAAR1SLC6A4HTR3EHTR3BHTR3A | |
| SCHEMBL18055675 | 0.78 | TAAR1 (0.52) | TAAR1MAOBIDO1AOC3DPP4 | |
| SCHEMBL10585881 | 0.78 | TAAR1 (0.47) | TAAR1HTR3EHTR3BHTR3AHTR3D | |
| SCHEMBL264969 | 0.78 | SLC6A2 (0.63) | TAAR1SLC6A4HTR3EHTR3BHTR3A | |
| SCHEMBL7973570 | 0.78 | TAAR1 (0.52) | TAAR1IDO1 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1665801-B | Anti tubercular drug: compositions and methods | DEPT OF HEALTH AND HUMAN SERVI | 2011-05-11 | — | — | CN | disclosed |
| EP-1653961-A4 | INHIBITORS OF AKT ACTIVITY | SMITHKLINE BEECHAM CORP (US) | 2009-04-01 | — | — | EP | disclosed |
| CN-1777608-A | fused pyrimidine derivatives | KYOWA HAKKO KOGYO KK (JP) | 2006-05-24 | — | — | CN | disclosed |
| EP-1653961-A1 | INHIBITORS OF AKT ACTIVITY | SMITHKLINE BEECHAM CORPORATION (US) | 2006-05-10 | — | — | EP | disclosed |
| CN-1665801-A | Anti tubercular drug: compositions and methods | DEPT OF HEALTH AND HUMAN SERVI (US) | 2005-09-07 | — | — | CN | disclosed |
| WO-2005011700-A1 | INHIBITORS OF Akt ACTIVITY | SMITHKLINE BEECHAM CORPORATION (US) | 2005-02-10 | — | — | WO | disclosed |
| CN-1040873-C | Arylidene-1-azacycloalkanes and arylalkyl-1-azacycloalkanes, their salts, medicaments containing these compounds and .... | THOMAE GMBH DR K (DE) | 1998-11-25 | — | — | CN | disclosed |
| CN-1090849-A | Arylidene-1-azacycloparaffin and aralkyl-1-azacycloparaffin, their salt contains medicament and the application and their preparation process of these compounds | THOMAE GMBH DR K (DE) | 1994-08-17 | — | — | CN | disclosed |