Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 1/20 | 0.38 |
| ▸ | NOS2 | P35228 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | DRD4 | P21917 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8946140 | 0.81 | HTT (0.32) | TDP1KDM4EMAPTALDH1A1 | |
| SCHEMBL8945744 | 0.81 | KCNH2 (0.31) | — | |
| SCHEMBL8945788 | 0.81 | MEN1 (0.38) | NOS3NOS2LMNASMN1; SMN2KDM4E | |
| SCHEMBL8946051 | 0.80 | NPEPPS (0.37) | LMNAMAPTDRD4ALDH1A1 | |
| Hydrochloric Acid SCHEMBL8946092 | 0.80 | MEN1 (0.37) | NOS3NOS2LMNASMN1; SMN2KDM4E | |
| Hydrochloric Acid SCHEMBL8945828 | 0.79 | HTT (0.31) | — | |
| SCHEMBL11270824 | 0.78 | CHRNB2 (0.37) | LMNAALDH1A1RECQL | |
| Hydrochloric Acid SCHEMBL8945986 | 0.78 | NPEPPS (0.36) | LMNAMAPTDRD4ALDH1A1 | |
| Hydrochloric Acid SCHEMBL8946103 | 0.78 | NPEPPS (0.36) | LMNAMAPTDRD4ALDH1A1 | |
| SCHEMBL8946144 | 0.78 | CYP19A1 (0.34) | RECQL |
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 | 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 |
| EP-0322582-A2 | 4-Heteroaryl-1,3-Benzodiazepines and 2-substituted-alpha-(heteroaryl)benzeneethanamines, a process for their preparation and their use us medicaments | HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) | 1989-07-05 | — | — | EP | disclosed |