Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 6/20 | 0.36 |
| ▸ | HTR2A | P28223 | 6/20 | 0.36 |
| ▸ | HRH1 | P35367 | 6/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.36 |
| ▸ | DRD2 | P14416 | 3/20 | 0.36 |
| ▸ | ADRA2B | P18089 | 3/20 | 0.36 |
| ▸ | ADRA2C | P18825 | 3/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.36 |
| ▸ | HTR2C | P28335 | 3/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.36 |
| ▸ | DRD3 | P35462 | 3/20 | 0.36 |
| ▸ | THPO | P40225 | 3/20 | 0.36 |
| ▸ | HTR2B | P41595 | 3/20 | 0.36 |
| ▸ | CACNA1B | Q00975 | 3/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9683465 | 0.92 | CARM1 (0.33) | SLC6A2HTR2AHRH1CYP3A4CYP2D6 | |
| SCHEMBL9684167 | 0.81 | ALDH1A1 (0.31) | HTT | |
| SCHEMBL9684133 | 0.81 | CYP2D6 (0.38) | SLC6A2HTR2AHRH1CYP2D6SLC6A3 | |
| SCHEMBL9683517 | 0.78 | HTT (0.30) | HTT | |
| SCHEMBL9683453 | 0.78 | OPRM1 (0.35) | SLC6A2SLC6A3HTTSLC6A4OPRM1 | |
| SCHEMBL9683476 | 0.77 | KDM1A (0.36) | SLC6A2HTR2AHRH1CYP2D6KDM4E | |
| SCHEMBL9683338 | 0.75 | POLB (0.34) | CYP3A4CYP2D6KDM4ETP53MEN1 | |
| SCHEMBL9682581 | 0.72 | HTT (0.35) | SLC6A2SLC6A3KDM4EHTTSLC6A4 | |
| SCHEMBL9684243 | 0.72 | CHRM2 (0.37) | CHRM2TP53HSD17B10KMT2AMAPK1 | |
| SCHEMBL9684281 | 0.71 | OPRM1 (0.37) | OPRM1SIGMAR1 |
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-0475187-A1 | Naphthothiophenimines for treating neuronal disorders caused by ischemia | BRISTOL-MYERS SQUIBB COMPANY (US) | 1992-03-18 | — | — | EP | disclosed |
| US-5064831-A | N-methyl-d-aspartate receptor antagonist | BRISTOL-MYERS SQUIBB CO. (US) | 1991-11-12 | — | — | US | disclosed |