Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 1/20 | 0.47 |
| ▸ | DRD3 | P35462 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | BCL2A1 | Q16548 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | HRH4 | Q9H3N8 | 6/20 | 0.44 |
| ▸ | HTR3B | O95264 | 2/20 | 0.43 |
| ▸ | HTR3A | P46098 | 2/20 | 0.43 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.43 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.43 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL9683227 | 0.99 | DRD2 (0.46) | DRD2DRD3ALDH1A1KDM4EMAPT | |
| SCHEMBL9681908 | 0.87 | MAT2A (0.48) | DRD2ALDH1A1KDM4EMAPTBCL2A1 | |
| SCHEMBL9680378 | 0.84 | ADRB1 (0.58) | DRD2DRD3ALDH1A1KDM4EMAPT | |
| SCHEMBL9681294 | 0.84 | SCN9A (0.44) | MAPTHRH4HTR3BHTR3AHTR3E | |
| Hydrochloric Acid SCHEMBL9682443 | 0.83 | SCN9A (0.43) | ALDH1A1KDM4EMAPTHRH4HTR3B | |
| Hydrochloric Acid SCHEMBL9681936 | 0.83 | ADRB1 (0.56) | DRD2DRD3ALDH1A1KDM4EMAPT | |
| SCHEMBL9680660 | 0.81 | PTGER1 (0.43) | DRD2ALDH1A1MAPTKMT2ALMNA | |
| SCHEMBL6125292 | 0.80 | KHK (0.56) | ALDH1A1KDM4EHRH4HTR3BHTR3A | |
| SCHEMBL9683234 | 0.79 | MEN1 (0.52) | ALDH1A1MAPTKMT2AHTR3BHTR3A | |
| Hydrochloric Acid SCHEMBL9682152 | 0.79 | KHK (0.54) | ALDH1A1KDM4EHRH4HTR3BHTR3A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4999356-A | Analgesics, antidepressants, anticonvulsants | HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) | 1991-03-12 | — | — | US | claimed |
| US-5134236-A | Analgesics, antidepressants, anticonvulsants | HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) | 1992-07-28 | — | — | US | disclosed |
| US-4999356-A | Analgesics, antidepressants, anticonvulsants | HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) | 1991-03-12 | — | — | US | disclosed |
| EP-0302423-A2 | 1-Phenyl-3-(1-piperazinyl)-1h-indazoles, a process and intermediates for their preparation, and the use thereof as medicaments | HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) | 1989-02-08 | — | — | EP | disclosed |