Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APAF1 | O14727 | 1/20 | 0.56 |
| ▸ | MME | P08473 | 2/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | BCHE | P06276 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.44 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.44 |
| ▸ | SRC | P12931 | 1/20 | 0.43 |
| ▸ | CASR | P41180 | 2/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.43 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.43 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.43 |
| ▸ | DRD1 | P21728 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9119155 | 1.00 | APAF1 (0.56) | APAF1MMECYP2D6CYP1A2CYP2C19 | |
| SCHEMBL23360816 | 0.87 | APAF1 (0.54) | APAF1MMECYP2C19CYP3A4MEN1 | |
| SCHEMBL7306322 | 0.85 | APAF1 (0.49) | APAF1BCHEMTNR1AMTNR1BANPEP | |
| SCHEMBL11437811 | 0.84 | APAF1 (0.51) | APAF1MMEADRA2ALMNAANPEP | |
| SCHEMBL28439487 | 0.82 | APAF1 (0.54) | APAF1MMETSHRMTNR1AMTNR1B | |
| SCHEMBL4118085 | 0.80 | MME (0.58) | APAF1MME | |
| SCHEMBL489520 | 0.80 | MME (0.58) | APAF1MME | |
| SCHEMBL489519 | 0.80 | MME (0.58) | APAF1MME | |
| SCHEMBL976204 | 0.80 | MME (0.58) | APAF1MME | |
| Hydrochloric Acid SCHEMBL4231798 | 0.79 | APAF1 (0.43) | APAF1BCHETP53ALOX15MTNR1A |
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-1995027729-A1 | OPIATE RECEPTOR LIGANDS | CHIRON CORPORATION (US) | 1995-10-19 | — | — | WO | disclosed |