Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 1/20 | 0.47 |
| ▸ | CYP51A1 | Q16850 | 1/20 | 0.42 |
| ▸ | CNR2 | P34972 | 1/20 | 0.41 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.41 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.40 |
| ▸ | STAT6 | P42226 | 1/20 | 0.40 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.40 |
| ▸ | PYGL | P06737 | 1/20 | 0.40 |
| ▸ | CCKBR | P32239 | 1/20 | 0.39 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.39 |
| ▸ | HTR3A | P46098 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7989861 | 1.00 | DRD2 (0.47) | DRD2CYP51A1CNR2TAS1R3TAS1R1 | |
| SCHEMBL8002427 | 0.88 | SMYD3 (0.47) | CYP51A1KDM4EALDH1A1HPGDHRH4 | |
| SCHEMBL7986132 | 0.88 | SMYD3 (0.47) | CYP51A1KDM4EALDH1A1HPGDHRH4 | |
| SCHEMBL7983271 | 0.81 | CCR1 (0.43) | TAS1R3TAS1R1STAT6CHRNA7HTR3A | |
| SCHEMBL7995048 | 0.81 | DRD2 (0.43) | DRD2CYP51A1CNR2TAS1R3TAS1R1 | |
| SCHEMBL16456822 | 0.80 | DRD2 (0.44) | DRD2CYP51A1CNR2TAS1R3TAS1R1 | |
| SCHEMBL1550688 | 0.78 | DRD2 (0.47) | DRD2CYP51A1CNR2TAS1R3TAS1R1 | |
| SCHEMBL1931303 | 0.76 | DRD2 (0.47) | DRD2CYP51A1CNR2TAS1R3TAS1R1 | |
| SCHEMBL1931738 | 0.76 | DRD2 (0.47) | DRD2CYP51A1CNR2TAS1R3TAS1R1 | |
| SCHEMBL1931683 | 0.76 | DRD2 (0.47) | DRD2CYP51A1CNR2TAS1R3TAS1R1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009146182-A1 | TRPV4 ANTAGONISTS | SMITHKLINE BEECHAM CORPORATION (US) | 2009-12-03 | — | — | WO | disclosed |