Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APAF1 | O14727 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.42 |
| ▸ | HTR1A | P08908 | 1/20 | 0.42 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.42 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.42 |
| ▸ | DRD1 | P21728 | 1/20 | 0.42 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.42 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.42 |
| ▸ | DRD3 | P35462 | 1/20 | 0.42 |
| ▸ | CASR | P41180 | 1/20 | 0.42 |
| ▸ | HTR2B | P41595 | 1/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL2065865 | 1.00 | APAF1 (0.43) | APAF1CYP3A4CHRM2HTR1AADRA2A | |
| SCHEMBL2066806 | 1.00 | APAF1 (0.43) | APAF1CYP3A4CHRM2HTR1AADRA2A | |
| SCHEMBL19616773 | 0.78 | CYP3A4 (0.47) | APAF1CYP3A4CHRM2HTR1AADRA2A | |
| SCHEMBL14943969 | 0.77 | CYP2C19 (0.42) | CHRM2CHRM1KCNH2LMNACYP1A2 | |
| SCHEMBL16791656 | 0.76 | SMN1; SMN2 (0.42) | CYP3A4CHRM2HTR1AADRA2AADORA3 | |
| SCHEMBL9194705 | 0.76 | CYP2C19 (0.52) | CHRM2CHRM1LMNACYP1A2CYP2C19 | |
| SCHEMBL3825799 | 0.76 | CYP2C19 (0.41) | CHRM2CHRM1LMNACYP1A2CYP2C19 | |
| SCHEMBL1902599 | 0.74 | SMN1; SMN2 (0.43) | APAF1CYP3A4CHRM2HTR1AADRA2A | |
| SCHEMBL12670498 | 0.73 | SMN1; SMN2 (0.42) | APAF1CYP3A4CHRM2HTR1AADRA2A | |
| SCHEMBL23014014 | 0.73 | CYP2C19 (0.48) | CYP3A4CHRM2CHRM1OPRM1DRD3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2099794-A2 | THIAZOLYL COMPOUNDS USEFUL AS KINASE INHIBITORS | Bristol-Myers Squibb Company (US) | 2009-09-16 | — | — | EP | disclosed |
| WO-2008079873-A2 | THIAZOLYL COMPOUNDS USEFUL AS KINASE INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2008-07-03 | — | — | WO | disclosed |
| WO-2008079873-A2 | THIAZOLYL COMPOUNDS USEFUL AS KINASE INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2008-07-03 | — | — | WO | disclosed |