Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | THPO | P40225 | 1/20 | 0.50 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | PTGER2 | P43116 | 4/20 | 0.47 |
| ▸ | PTGER1 | P34995 | 6/20 | 0.44 |
| ▸ | HSD17B3 | P37058 | 2/20 | 0.44 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.43 |
| ▸ | SHMT2 | P34897 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9275497 | 0.85 | MEN1 (0.54) | MEN1ALDH1A1CYP1A2CYP3A4CYP2D6 | |
| Hydrazine SCHEMBL11827760 | 0.84 | MEN1 (0.66) | MEN1ALDH1A1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL8788236 | 0.84 | HSD17B3 (0.53) | MEN1ALDH1A1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL676665 | 0.84 | MEN1 (0.69) | MEN1ALDH1A1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL9270284 | 0.84 | MAPT (0.53) | MEN1ALDH1A1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL9273944 | 0.84 | ALDH1A1 (0.50) | MEN1ALDH1A1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL9274813 | 0.84 | MEN1 (0.50) | MEN1ALDH1A1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL9272738 | 0.81 | MEN1 (0.47) | MEN1ALDH1A1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL9275047 | 0.81 | MAPT (0.50) | MEN1ALDH1A1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL9258373 | 0.81 | MEN1 (0.47) | MEN1ALDH1A1CYP1A2CYP3A4CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| US-5461046-A | Analgesics | G. D. SEARLE & CO. (US) | 1995-10-24 | — | — | US | disclosed |
| US-5304644-A | 1-,2-,3-,4-,5-,6-,7-,8- and/or 9 substituted dibenzoxazepine compounds, pharmaceutical compositions and methods for treating pain | G. D. SEARLE & CO. (US) | 1994-04-19 | — | — | US | disclosed |