Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 1/20 | 0.42 |
| ▸ | TRPV4 | Q9HBA0 | 7/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | CNR1 | P21554 | 2/20 | 0.40 |
| ▸ | CNR2 | P34972 | 2/20 | 0.40 |
| ▸ | ITGAV | P06756 | 1/20 | 0.40 |
| ▸ | FABP4 | P15090 | 2/20 | 0.39 |
| ▸ | ITGA1 | P56199 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL4135486 | 0.84 | CCR1 (0.42) | CCR1TRPV4GAACNR1CNR2 | |
| SCHEMBL4773183 | 0.80 | GAA (0.40) | CCR1TRPV4GAACNR1CNR2 | |
| SCHEMBL4140000 | 0.78 | CCR1 (0.47) | CCR1TRPV4GAACNR1CNR2 | |
| SCHEMBL14605764 | 0.77 | TRPV4 (0.43) | CCR1TRPV4GAACNR1FABP4 | |
| SCHEMBL13872499 | 0.76 | AAK1 (0.46) | CCR1TRPV4GAAKDM4EALDH1A1 | |
| SCHEMBL4127274 | 0.76 | TRPV4 (0.47) | CCR1TRPV4GAAALDH1A1 | |
| SCHEMBL3913649 | 0.76 | ITGA1 (0.43) | CCR1TRPV4CNR2ITGAVITGA1 | |
| SCHEMBL14606011 | 0.75 | CCR1 (0.39) | CCR1TRPV4GAACNR1CNR2 | |
| SCHEMBL4771053 | 0.75 | CCR1 (0.39) | CCR1TRPV4GAACNR1CNR2 | |
| SCHEMBL4132204 | 0.75 | MAPK1 (0.45) | CCR1TRPV4CNR1FABP4ITGA1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1940785-A2 | ACYCLIC 1,4-DIAMINES AND USES THEREOF | SmithKline Beecham Corporation (US) | 2008-07-09 | — | — | EP | disclosed |
| WO-2007030761-A2 | ACYCLIC 1,4-DIAMINES AND USES THEREOF | SMITHKLINE BEECHAM CORPORATION (US) | 2007-03-15 | — | — | WO | disclosed |