Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KHK | P50053 | 2/20 | 0.48 |
| ▸ | DRD4 | P21917 | 1/20 | 0.46 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | KDM2B | Q8NHM5 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | TTK | P33981 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| Fumaric Acid SCHEMBL9681235 | 0.91 | KHK (0.44) | KHKDRD4GRM2ALDH1A1KDM4E | |
| Fumaric Acid SCHEMBL9681243 | 0.91 | KHK (0.44) | KHKDRD4GRM2ALDH1A1KDM4E | |
| SCHEMBL9680624 | 0.87 | CYP1A2 (0.46) | KHKDRD4GRM2KDM4EKMT2A | |
| SCHEMBL9763064 | 0.87 | KHK (0.51) | KHKALDH1A1KDM4ENPC1KMT2A | |
| SCHEMBL9680665 | 0.86 | MAPK1 (0.46) | DRD4GRM2ALDH1A1KDM4EKMT2A | |
| Hydrochloric Acid SCHEMBL9681944 | 0.86 | KHK (0.50) | KHKALDH1A1KDM4ENPC1KMT2A | |
| SCHEMBL9680355 | 0.85 | SLC6A2 (0.44) | DRD4GRM2KDM2BMAPTRAB9A | |
| SCHEMBL9683244 | 0.85 | SIGMAR1 (0.54) | DRD4GRM2ALDH1A1CYP1A2CYP3A4 | |
| Hydrochloric Acid SCHEMBL9681380 | 0.84 | SIGMAR1 (0.53) | DRD4GRM2ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL9682489 | 0.82 | HTR6 (0.47) | KHKALDH1A1KDM4ECYP1A2MAPT |
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 2 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 |
| 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 | claimed |