Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.54 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.49 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.49 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | HTR1A | P08908 | 2/20 | 0.47 |
| ▸ | DRD2 | P14416 | 1/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.47 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | DRD4 | P21917 | 1/20 | 0.43 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 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 SCHEMBL9681380 | 0.99 | SIGMAR1 (0.53) | SIGMAR1ADRA1DADRA1AADRA1BMAPT | |
| SCHEMBL9681250 | 0.89 | HTR1A (0.60) | SIGMAR1MAPTALDH1A1MAPK1LMNA | |
| SCHEMBL9680665 | 0.88 | MAPK1 (0.46) | ADRA1DADRA1AADRA1BMAPTALDH1A1 | |
| SCHEMBL9763384 | 0.85 | KHK (0.48) | MAPTALDH1A1LMNADRD4GRM2 | |
| SCHEMBL9680624 | 0.84 | CYP1A2 (0.46) | MAPTMAPK1LMNAHSD17B10HTR1A | |
| SCHEMBL9680355 | 0.83 | SLC6A2 (0.44) | MAPTHTR1ADRD2SLC6A2SLC6A4 | |
| Fumaric Acid SCHEMBL9681243 | 0.80 | KHK (0.44) | ALDH1A1MAPK1LMNADRD4GRM2 | |
| Fumaric Acid SCHEMBL9681235 | 0.80 | KHK (0.44) | ALDH1A1MAPK1LMNADRD4GRM2 | |
| SCHEMBL9682489 | 0.79 | HTR6 (0.47) | SIGMAR1MAPTALDH1A1HTR1ANPSR1 | |
| Hydrochloric Acid SCHEMBL9680573 | 0.78 | HTR6 (0.46) | SIGMAR1MAPTALDH1A1HTR1ANPSR1 |
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 |