Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK14 | Q16539 | 3/20 | 0.52 |
| ▸ | MAPK11 | Q15759 | 2/20 | 0.52 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.52 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.52 |
| ▸ | MELK | Q14680 | 4/20 | 0.51 |
| ▸ | FLT3 | P36888 | 1/20 | 0.44 |
| ▸ | GSK3B | P49841 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.40 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.40 |
| ▸ | CSNK1D | P48730 | 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 | |
|---|---|---|---|---|
| SCHEMBL6337994 | 0.87 | MELK (0.51) | MAPK14MAPK11MAPK13MAPK12MELK | |
| SCHEMBL5829487 | 0.87 | ALDH1A1 (0.51) | MAPK14MAPK11MELKKMT2APTGS2 | |
| SCHEMBL5829519 | 0.84 | CYP17A1 (0.51) | MAPK14MAPK11FLT3GSK3BKMT2A | |
| SCHEMBL7250809 | 0.82 | AKR1C3 (0.46) | KMT2AGAARAB9AALDH1A1DRD2 | |
| SCHEMBL5829983 | 0.76 | KDM4E (0.41) | KMT2ANPC1RAB9AKDM4EALDH1A1 | |
| SCHEMBL5829985 | 0.76 | KDM4E (0.41) | KMT2ANPC1RAB9AKDM4EALDH1A1 | |
| SCHEMBL6310322 | 0.71 | RAB9A (0.50) | MAPK14FLT3GSK3BKMT2APTGS2 | |
| SCHEMBL8110243 | 0.70 | ALDH1A1 (0.52) | MAPK14FLT3GSK3BKMT2APTGS2 | |
| SCHEMBL5463406 | 0.69 | ROCK2 (0.44) | MAPK14MAPK11MAPK13MAPK12MELK | |
| SCHEMBL28337260 | 0.69 | MELK (0.69) | MELKKMT2ANPC1GAARAB9A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6617324-B1 | Phenyl, cyclohexyl and pyridinyl or pyrimidinyl-substituted | G. D. SEARLE & COMPANY | 2003-09-09 | — | — | US | disclosed |