Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 3/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9425330 | 0.84 | L3MBTL1 (0.38) | MAPTL3MBTL1TDP1ALDH1A1PDE7A | |
| Hydrochloric Acid SCHEMBL8945759 | 0.83 | L3MBTL1 (0.37) | MAPTL3MBTL1TDP1ALDH1A1PDE7A | |
| SCHEMBL9425585 | 0.81 | CYP3A4 (0.36) | TDP1ALDH1A1SMN1; SMN2TSHRCYP3A4 | |
| SCHEMBL8945962 | 0.71 | ALDH1A1 (0.46) | MAPTALDH1A1PDE7ANPSR1SMN1; SMN2 | |
| SCHEMBL28859856 | 0.69 | MAPT (0.50) | MAPTL3MBTL1TDP1ALDH1A1NPSR1 | |
| SCHEMBL9425664 | 0.68 | MAPK1 (0.41) | MAPTALDH1A1POLBKMT2AMAPK1 | |
| SCHEMBL357928 | 0.68 | PDK1 (0.55) | MAPTL3MBTL1TDP1ALDH1A1PDE7A | |
| Hydrochloric Acid SCHEMBL8945916 | 0.68 | CYP3A4 (0.30) | TDP1CYP3A4 | |
| SCHEMBL5739464 | 0.68 | ALDH1A1 (0.50) | MAPTL3MBTL1TDP1ALDH1A1NPSR1 | |
| Hydrochloric Acid SCHEMBL8945995 | 0.68 | MAPK1 (0.40) | MAPTALDH1A1POLBKMT2AMAPK1 |
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-5292760-A | 4-heteroaryl-1,3-benzodiazepines and 2-substituted-α-(heteroaryl)benzeneethanamines | HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) | 1994-03-08 | — | — | 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 |