Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.32 |
| ▸ | DRD2 | P14416 | 6/20 | 0.32 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | RECQL | P46063 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | CTSD | P07339 | 1/20 | 0.31 |
| ▸ | HRH1 | P35367 | 3/20 | 0.30 |
| ▸ | DRD4 | P21917 | 2/20 | 0.30 |
| ▸ | HTR2C | P28335 | 2/20 | 0.30 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | THPO | P40225 | 1/20 | 0.30 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.30 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8945744 | 0.85 | KCNH2 (0.31) | — | |
| SCHEMBL8945930 | 0.82 | HTT (0.34) | HRH4DRD2CYP2D6MEN1RECQL | |
| SCHEMBL8945774 | 0.80 | SLC6A2 (0.40) | HRH4CYP2D6MEN1KMT2ACYP1A2 | |
| Hydrochloric Acid SCHEMBL8945896 | 0.80 | HTT (0.33) | HRH4CYP2D6MEN1RECQLKMT2A | |
| SCHEMBL9583619 | 0.78 | MAOB (0.44) | OPRM1MEN1RECQLKMT2A | |
| Dazepinil SCHEMBL499286 | 0.77 | CHRNB2 (0.40) | CYP2D6MEN1RECQLKMT2A | |
| SCHEMBL8945994 | 0.76 | HSD17B10 (0.34) | HRH4CYP2D6MEN1RECQLKMT2A | |
| SCHEMBL8946008 | 0.76 | SLC6A4 (0.41) | HRH4DRD2OPRM1CYP2D6MEN1 | |
| SCHEMBL9582481 | 0.75 | DRD2 (0.34) | DRD2CYP2D6MEN1KMT2ANPC1 | |
| SCHEMBL11266015 | 0.75 | MAOA (0.43) | CYP2D6MEN1RECQLKMT2ATP53 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5510346-A | ANTIDEPRESSANTS, ANTIANXIETY AGENTS | HOECHST MARION ROUSSEL, INC. (US) | 1996-04-23 | — | — | US | claimed |
| US-5510346-A | ANTIDEPRESSANTS, ANTIANXIETY AGENTS | HOECHST MARION ROUSSEL, INC. (US) | 1996-04-23 | — | — | US | disclosed |
| US-5292760-A | 4-heteroaryl-1,3-benzodiazepines and 2-substituted-α-(heteroaryl)benzeneethanamines | HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) | 1994-03-08 | — | — | US | disclosed |