Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 1/20 | 0.37 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.37 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.36 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | FLT1 | P17948 | 2/20 | 0.35 |
| ▸ | KDR | P35968 | 2/20 | 0.35 |
| ▸ | SCD | O00767 | 2/20 | 0.35 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.35 |
| ▸ | SELE | P16581 | 1/20 | 0.35 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.35 |
| ▸ | TNIK | Q9UKE5 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL14009351 | 0.89 | RAB9A (0.42) | S1PR1APOBEC3AAPOBEC3GHSP90AA1ATM | |
| SCHEMBL14009066 | 0.82 | RAB9A (0.41) | S1PR1APOBEC3AAPOBEC3GHSP90AA1ATM | |
| SCHEMBL14009089 | 0.80 | S1PR1 (0.42) | S1PR1APOBEC3AAPOBEC3GHSP90AA1ATM | |
| SCHEMBL14009068 | 0.78 | RAB9A (0.44) | S1PR1HSP90AA1ATMRAB9ARXFP1 | |
| SCHEMBL14008951 | 0.78 | NPC1 (0.43) | S1PR1APOBEC3AAPOBEC3GHSP90AA1ATM | |
| SCHEMBL14008953 | 0.77 | PDE7A (0.46) | S1PR1RAB9AKMT2A | |
| SCHEMBL14009047 | 0.76 | CCR5 (0.44) | S1PR1ROCK2 | |
| SCHEMBL14009309 | 0.76 | RAB9A (0.43) | S1PR1HSP90AA1ATMRAB9ARXFP1 | |
| SCHEMBL14609772 | 0.75 | DDX3X (0.46) | S1PR1RAB9AROCK2KMT2ATNIK | |
| SCHEMBL14008991 | 0.75 | CYP1A2 (0.42) | S1PR1HSP90AA1ATMRAB9ARXFP1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7446195-B2 | High affinity thiophene-based and furan-based kinase ligands | SCHERING CORPORATION (US) | 2008-11-04 | — | — | US | disclosed |