Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | ME2 | P23368 | 3/20 | 0.46 |
| ▸ | ME1 | P48163 | 3/20 | 0.46 |
| ▸ | ME3 | Q16798 | 3/20 | 0.46 |
| ▸ | GRM5 | P41594 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | GRIN2B | Q13224 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | OPRD1 | P41143 | 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 | |
|---|---|---|---|---|
| SCHEMBL30796957 | 0.85 | TRPV1 (0.53) | HDAC1SMN1; SMN2RAB9AGRM5MEN1 | |
| SCHEMBL6350032 | 0.80 | ME2 (0.70) | HDAC1SMN1; SMN2RAB9AKDM4EALDH1A1 | |
| SCHEMBL6950816 | 0.80 | RET (0.54) | — | |
| SCHEMBL8145178 | 0.78 | HDAC1 (0.46) | HDAC1GRIN2BCYP3A4CYP2D6CYP2C9 | |
| SCHEMBL6478335 | 0.78 | HDAC1 (0.61) | HDAC1SMN1; SMN2RAB9AKDM4EALDH1A1 | |
| SCHEMBL13981711 | 0.78 | HDAC1 (0.67) | HDAC1SMN1; SMN2RAB9AKDM4EALDH1A1 | |
| SCHEMBL6479590 | 0.77 | ALDH1A1 (0.63) | HDAC1SMN1; SMN2RAB9AKDM4EALDH1A1 | |
| SCHEMBL8146572 | 0.77 | HDAC1 (0.48) | HDAC1SMN1; SMN2RAB9AKDM4EALDH1A1 | |
| SCHEMBL22581731 | 0.77 | GRM5 (0.54) | HDAC1SMN1; SMN2RAB9AALDH1A1GRM5 | |
| SCHEMBL6489304 | 0.77 | HDAC1 (0.55) | HDAC1SMN1; SMN2RAB9AKDM4EALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6093716-A | Substituted 2-pyrimidineamines and processes for their preparation | CELLTECH THERAPEUTICS, LIMITED (GB) | 2000-07-25 | — | — | US | disclosed |
| EP-0929549-A1 | SUBSTITUTED 2-PYRIMIDINEAMINES, THEIR PREPARATION AND THEIR USE AS PROTEINE KINASE INHIBITORS | CELLTECH THERAPEUTICS LIMITED (GB) | 1999-07-21 | — | — | EP | disclosed |
| WO-1998011095-A1 | SUBSTITUTED 2-PYRIMIDINEAMINES, THEIR PREPARATION AND THEIR USE AS PROTEINE KINASE INHIBITORS | CELLTECH THERAPEUTICS LIMITED (GB) | 1998-03-19 | — | — | WO | disclosed |