Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK1 | Q13464 | 4/20 | 0.46 |
| ▸ | TRPC3 | Q13507 | 1/20 | 0.43 |
| ▸ | TRPC7 | Q9HCX4 | 1/20 | 0.43 |
| ▸ | TRPC5 | Q9UL62 | 1/20 | 0.43 |
| ▸ | MTOR | P42345 | 1/20 | 0.41 |
| ▸ | UBE2M | P61081 | 1/20 | 0.41 |
| ▸ | DCUN1D1 | Q96GG9 | 1/20 | 0.41 |
| ▸ | MC4R | P32245 | 3/20 | 0.40 |
| ▸ | MC3R | P41968 | 3/20 | 0.40 |
| ▸ | MC5R | P33032 | 2/20 | 0.40 |
| ▸ | EPOR | P19235 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | DEGS1 | O15121 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | SLC1A3 | P43003 | 2/20 | 0.38 |
| ▸ | SLC1A2 | P43004 | 2/20 | 0.38 |
| ▸ | SLC1A1 | P43005 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9200973 | 1.00 | ROCK1 (0.46) | ROCK1TRPC3TRPC7TRPC5MTOR | |
| SCHEMBL8118835 | 0.90 | ROCK1 (0.42) | ROCK1TRPC3TRPC7TRPC5MTOR | |
| SCHEMBL8121290 | 0.79 | SLC1A3 (0.41) | ROCK1UBE2MDCUN1D1MAPTCYP1A2 | |
| SCHEMBL7750609 | 0.75 | ROCK1 (0.38) | ROCK1TRPC3TRPC7TRPC5UBE2M | |
| SCHEMBL8120145 | 0.74 | ESR1 (0.41) | TRPC3TRPC7TRPC5MC4RMC3R | |
| SCHEMBL8121675 | 0.74 | MC3R (0.47) | TRPC3TRPC7TRPC5MC4RMC3R | |
| SCHEMBL8365166 | 0.73 | MC4R (0.43) | TRPC3TRPC7TRPC5MC4RMC3R | |
| SCHEMBL7850361 | 0.73 | MC4R (0.43) | TRPC3TRPC7TRPC5MC4RMC3R | |
| SCHEMBL21461808 | 0.72 | EPOR (0.44) | MC4RMC3RMC5REPORMEN1 | |
| SCHEMBL9203013 | 0.71 | F7 (0.45) | MAPTDEGS1 |
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-0680469-A1 | AMINOACID DERIVATES, MEDICAMENTS CONTAINING THESE COMPOUNDS AND PROCESS FOR PREPARING THE SAME | Dr. Karl Thomae GmbH (DE) | 1995-11-08 | — | — | EP | disclosed |
| WO-1994017035-A1 | AMINOACID DERIVATES, MEDICAMENTS CONTAINING THESE COMPOUNDS AND PROCESS FOR PREPARING THE SAME | DR. KARL THOMAE GMBH (DE) | 1994-08-04 | — | — | WO | disclosed |