Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRD1 | P41143 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.44 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.42 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.42 |
| ▸ | DPP4 | P27487 | 2/20 | 0.41 |
| ▸ | TACR1 | P25103 | 1/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.41 |
| ▸ | FAP | Q12884 | 1/20 | 0.41 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.41 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.41 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.41 |
| ▸ | CCNC | P24863 | 1/20 | 0.40 |
| ▸ | CDK8 | P49336 | 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 | |
|---|---|---|---|---|
| SCHEMBL30964008 | 0.86 | SPHK2 (0.43) | OPRD1ROCK2RIPK1PDE2A | |
| SCHEMBL5197715 | 0.84 | CCNC (0.53) | KMT2ARIPK1CCNCCDK8ALDH1A1 | |
| SCHEMBL28148131 | 0.84 | TACR1 (0.49) | OPRD1ROCK2RIPK1KCNH2MCHR1 | |
| SCHEMBL17142310 | 0.82 | RIPK1 (0.51) | OPRD1ROCK2RIPK1KCNH2MCHR1 | |
| SCHEMBL26676726 | 0.82 | EPHX2 (0.52) | GAARIPK1HRH3KDM4EALDH1A1 | |
| Trifluoroacetic Acid SCHEMBL28142751 | 0.82 | RIPK1 (0.55) | RIPK1 | |
| SCHEMBL17454889 | 0.81 | RIPK1 (0.50) | ROCK2RIPK1KCNH2MCHR1DPP4 | |
| SCHEMBL29356757 | 0.81 | TRPC3 (0.48) | GAAROCK2HPGDRIPK1ALDH1A1 | |
| SCHEMBL938757 | 0.80 | RIPK1 (0.59) | RIPK1 | |
| Trifluoroacetic Acid SCHEMBL18050102 | 0.77 | RIPK1 (0.59) | TDP1RIPK1 |
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-1569646-A2 | PIPERIDINE DERIVATIVES AS CCR5 ANTAGONISTS | SMITHKLINE BEECHAM CORPORATION (US) | 2005-09-07 | — | — | EP | disclosed |
| WO-2004054974-A2 | PIPERIDINE DERIVATIVES AS CCR5 ANTAGONISTS | SMITHKLINE BEECHAM CORPORATION (US) | 2004-07-01 | — | — | WO | disclosed |