Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KHK | P50053 | 13/20 | 0.53 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.51 |
| ▸ | HTR3A | P46098 | 1/20 | 0.45 |
| ▸ | HTR2C | P28335 | 1/20 | 0.43 |
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 SCHEMBL9680719 | 0.99 | KHK (0.52) | KHKADRB1HTR3AHTR2C | |
| SCHEMBL2710715 | 0.89 | KHK (0.54) | KHKADRB1HTR3AHTR2C | |
| Hydrochloric Acid SCHEMBL9681346 | 0.87 | KHK (0.53) | KHKADRB1HTR3AHTR2C | |
| SCHEMBL9681305 | 0.86 | KHK (0.47) | KHKHTR3AHTR2C | |
| SCHEMBL9681327 | 0.86 | KHK (0.47) | KHKHTR2C | |
| SCHEMBL9681720 | 0.86 | KHK (0.47) | KHKADRB1HTR3AHTR2C | |
| SCHEMBL9681219 | 0.86 | KHK (0.56) | KHKADRB1HTR3A | |
| SCHEMBL9762766 | 0.85 | KHK (0.52) | KHKHTR3A | |
| Hydrochloric Acid SCHEMBL9681291 | 0.85 | KHK (0.55) | KHKADRB1HTR3A | |
| Hydrochloric Acid SCHEMBL9681492 | 0.84 | KHK (0.51) | KHKHTR3A |
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 |