Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAPGEF4 | Q8WZA2 | 3/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.34 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.30 |
| ▸ | ACHE | P22303 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL1062516 | 0.95 | RAPGEF4 (0.39) | RAPGEF4CYP1A2CYP2A6KDM4ELMNA | |
| SCHEMBL7940291 | 0.75 | CYP3A4 (0.39) | CYP1A2CYP2A6TSHR | |
| SCHEMBL24122988 | 0.74 | CYP3A4 (0.46) | ALDH1A1GAAACHE | |
| SCHEMBL28307760 | 0.74 | ALDH1A1 (0.41) | KDM4ELMNAALDH1A1MAPTTSHR | |
| SCHEMBL5476479 | 0.73 | PYCR1 (0.35) | — | |
| SCHEMBL1249412 | 0.72 | CYP1A2 (0.43) | CYP1A2CYP2A6ALDH1A1TSHRACHE | |
| SCHEMBL5476477 | 0.72 | KDM4E (0.32) | KDM4E | |
| SCHEMBL7067381 | 0.71 | RAPGEF4 (0.43) | RAPGEF4CYP1A2CYP2A6KDM4ELMNA | |
| SCHEMBL18050283 | 0.71 | RAPGEF4 (0.43) | RAPGEF4CYP1A2CYP2A6KDM4ELMNA | |
| SCHEMBL18050282 | 0.71 | RAPGEF4 (0.43) | RAPGEF4CYP1A2CYP2A6KDM4ELMNA |
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-6288279-B1 | THEIR PREPARATION PROCESS AND THEIR USE IN ASYMMETRICAL CATALYSIS. REARRANGING A DIPHOSPHOLE, REACTING THE DIPHOSPHOLE WITH AN ACETYLENIC COMPOUND TO FORM THE DIPHOSPHINE | RHODIA CHIMIE (FR) | 2001-09-11 | — | — | US | claimed |