Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.47 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.47 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.47 |
| ▸ | MC4R | P32245 | 1/20 | 0.44 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.42 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.42 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.42 |
| ▸ | CCR5 | P51681 | 1/20 | 0.41 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.40 |
| ▸ | DRD4 | P21917 | 1/20 | 0.39 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8579167 | 1.00 | LMNA (0.49) | LMNASMN1; SMN2CYP2D6MAPTKDM4E | |
| SCHEMBL8579169 | 1.00 | LMNA (0.49) | LMNASMN1; SMN2CYP2D6MAPTKDM4E | |
| SCHEMBL8566029 | 0.83 | LMNA (0.52) | LMNASMN1; SMN2CYP2D6MAPTKDM4E | |
| SCHEMBL8564803 | 0.83 | LMNA (0.52) | LMNASMN1; SMN2CYP2D6MAPTKDM4E | |
| SCHEMBL4673678 | 0.83 | LMNA (0.52) | LMNASMN1; SMN2CYP2D6MAPTKDM4E | |
| SCHEMBL844128 | 0.83 | LMNA (0.52) | LMNASMN1; SMN2CYP2D6MAPTKDM4E | |
| SCHEMBL14026665 | 0.82 | CYP2D6 (0.55) | LMNASMN1; SMN2CYP2D6MAPTKDM4E | |
| SCHEMBL10280648 | 0.82 | CYP2D6 (0.55) | LMNASMN1; SMN2CYP2D6MAPTKDM4E | |
| SCHEMBL5453145 | 0.81 | LMNA (0.55) | LMNASMN1; SMN2CYP2D6MAPTKDM4E | |
| SCHEMBL7459001 | 0.81 | LMNA (0.55) | LMNASMN1; SMN2CYP2D6MAPTKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-0581538-B1 | 4-Substituted 1,2,4-triazole derivatives | MERCK SHARP & DOHME (GB) | 1999-03-03 | — | — | EP | disclosed |
| CN-1037101-C | 4-substituted 1,2,4-triazole derivatives | MERCK SHARP & DOHME (GB) | 1998-01-21 | — | — | CN | disclosed |
| US-5554629-A | HEADACHES | MERCK, SHARP & DOHME LTD. (GB) | 1996-09-10 | — | — | US | disclosed |
| EP-0581538-A1 | 4-Substituted 1,2,4-triazole derivatives | MERCK SHARP & DOHME LTD. (GB) | 1994-02-02 | — | — | EP | disclosed |