Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BDKRB2 | P30411 | 1/20 | 0.47 |
| ▸ | NPC1L1 | Q9UHC9 | 2/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | OPRL1 | P41146 | 7/20 | 0.44 |
| ▸ | OPRM1 | P35372 | 6/20 | 0.42 |
| ▸ | OPRD1 | P41143 | 6/20 | 0.42 |
| ▸ | OPRK1 | P41145 | 6/20 | 0.42 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | DRD4 | P21917 | 1/20 | 0.41 |
| ▸ | DRD3 | P35462 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL9999121 | 0.93 | MEN1 (0.44) | BDKRB2MEN1CYP3A4CYP2D6KMT2A | |
| SCHEMBL318845 | 0.88 | OPRL1 (0.49) | BDKRB2NPC1L1HSD17B10OPRL1OPRM1 | |
| SCHEMBL318495 | 0.86 | NPC1L1 (0.45) | BDKRB2NPC1L1OPRL1OPRM1OPRD1 | |
| SCHEMBL318680 | 0.82 | NPC1L1 (0.48) | BDKRB2NPC1L1HSD17B10OPRL1OPRM1 | |
| SCHEMBL5556302 | 0.82 | OPRM1 (0.53) | BDKRB2NPC1L1HSD17B10OPRL1OPRM1 | |
| SCHEMBL318592 | 0.81 | KMT2A (0.51) | BDKRB2NPC1L1HSD17B10OPRL1OPRM1 | |
| SCHEMBL173699 | 0.81 | BDKRB2 (0.59) | BDKRB2NPC1L1HSD17B10OPRL1OPRM1 | |
| SCHEMBL1415422 | 0.80 | HSD17B10 (0.52) | BDKRB2NPC1L1HSD17B10OPRL1OPRM1 | |
| SCHEMBL319406 | 0.80 | BDKRB2 (0.43) | BDKRB2NPC1L1HSD17B10 | |
| SCHEMBL18601755 | 0.79 | NPC1L1 (0.59) | BDKRB2NPC1L1OPRL1OPRM1OPRK1 |
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-2582701-A1 | D2 ANTAGONISTS, METHODS OF SYNTHESIS AND METHODS OF USE | Altos Therapeutics, LLC (US) | 2013-04-24 | — | — | EP | disclosed |
| WO-2011160084-A1 | D2 ANTAGONISTS, METHODS OF SYNTHESIS AND METHODS OF USE | Altos Therapeutics, LLC (US) | 2011-12-22 | — | — | WO | disclosed |