Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.49 |
| ▸ | OPRM1 | P35372 | 7/20 | 0.49 |
| ▸ | OPRK1 | P41145 | 7/20 | 0.49 |
| ▸ | OPRD1 | P41143 | 5/20 | 0.49 |
| ▸ | ESR1 | P03372 | 1/20 | 0.46 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.46 |
| ▸ | CHI3L1 | P36222 | 1/20 | 0.46 |
| ▸ | CHIT1 | Q13231 | 1/20 | 0.46 |
| ▸ | CHI3L2 | Q15782 | 1/20 | 0.46 |
| ▸ | CHIA | Q9BZP6 | 1/20 | 0.46 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.46 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | DRD3 | P35462 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL17285885 | 0.87 | PKM (0.46) | HTR2AOPRM1OPRK1OPRD1CHIT1 | |
| SCHEMBL6836213 | 0.87 | KDM4E (0.58) | HTR2AOPRM1OPRK1OPRD1CHI3L1 | |
| SCHEMBL6836212 | 0.87 | KDM4E (0.58) | HTR2AOPRM1OPRK1OPRD1CHI3L1 | |
| SCHEMBL17284585 | 0.86 | CHIA (0.46) | HTR2AOPRM1OPRK1OPRD1CHIT1 | |
| SCHEMBL22878125 | 0.86 | CHIA (0.44) | HTR2AOPRM1OPRK1OPRD1CHIT1 | |
| SCHEMBL17282029 | 0.83 | CHIA (0.45) | HTR2AOPRM1OPRK1OPRD1CHIT1 | |
| SCHEMBL1967611 | 0.83 | CHIA (0.54) | HTR2ACHI3L1CHIT1CHI3L2CHIA | |
| SCHEMBL1968987 | 0.83 | CHIA (0.54) | HTR2ACHI3L1CHIT1CHI3L2CHIA | |
| SCHEMBL1242233 | 0.81 | TAAR1 (0.60) | HTR2ACHI3L1CHIT1CHI3L2CHIA | |
| SCHEMBL27817745 | 0.81 | CHIT1 (0.63) | HTR2ACHI3L1CHIT1CHI3L2CHIA |
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 |
|---|---|---|---|---|---|---|---|
| CN-102164896-A | Phenethylamide derivatives and their heterocyclic analogues | ACTELION PHARMACEUTICALS LTD | 2011-08-24 | — | — | CN | disclosed |