Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 8/20 | 0.43 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.39 |
| ▸ | DHODH | Q02127 | 3/20 | 0.36 |
| ▸ | TGFBR1 | P36897 | 2/20 | 0.36 |
| ▸ | FABP3 | P05413 | 1/20 | 0.35 |
| ▸ | FABP4 | P15090 | 1/20 | 0.35 |
| ▸ | MPO | P05164 | 1/20 | 0.35 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.35 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.34 |
| ▸ | ACVR1B | P36896 | 1/20 | 0.34 |
| ▸ | ACVRL1 | P37023 | 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 | |
|---|---|---|---|---|
| SCHEMBL4666092 | 0.86 | ADORA1 (0.46) | ADORA1ADORA2AADORA2BFABP3FABP4 | |
| SCHEMBL4668225 | 0.84 | ADORA1 (0.44) | ADORA1ADORA2AADORA2BDHODHFABP3 | |
| SCHEMBL4633959 | 0.84 | ADORA1 (0.44) | ADORA1ADORA2AADORA2BDHODHTGFBR1 | |
| SCHEMBL4666257 | 0.80 | ADORA1 (0.48) | ADORA1DHODH | |
| SCHEMBL14600439 | 0.80 | ADORA1 (0.47) | ADORA1DHODH | |
| SCHEMBL14600188 | 0.79 | ADORA1 (0.44) | ADORA1ADORA2AADORA2BKDM4C | |
| SCHEMBL14600260 | 0.76 | DHODH (0.46) | ADORA1DHODH | |
| SCHEMBL4667046 | 0.74 | ADORA1 (0.52) | ADORA1ADORA2BFABP3FABP4KDM4C | |
| SCHEMBL4668860 | 0.72 | KCNMA1 (0.38) | TGFBR1KDM4ENUDT1 | |
| SCHEMBL5090346 | 0.70 | ADORA1 (0.59) | ADORA1ADORA2B |
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-1928455-A1 | ANILINOPYRAZOLE DERIVATIVES USEFUL FOR THE TREATMENT OF DIABETES | Bayer Healthcare, LLC (US) | 2008-06-11 | — | — | EP | disclosed |
| WO-2007027842-A1 | ANILINOPYRAZOLE DERIVATIVES USEFUL FOR THE TREATMENT OF DIABETES | BAYER HEALTHCARE LLC (US) | 2007-03-08 | — | — | WO | disclosed |
| WO-2007027842-A1 | ANILINOPYRAZOLE DERIVATIVES USEFUL FOR THE TREATMENT OF DIABETES | BAYER HEALTHCARE LLC (US) | 2007-03-08 | — | — | WO | disclosed |