Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAPGEF4 | Q8WZA2 | 2/20 | 0.47 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.40 |
| ▸ | PDE2A | O00408 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 3/20 | 0.39 |
| ▸ | RAB9A | P51151 | 3/20 | 0.39 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.35 |
| ▸ | MAP2K2 | P36507 | 1/20 | 0.35 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL13344096 | 0.84 | ESR1 (0.45) | RAPGEF4TRPA1EGFRCYP1A2CYP2A6 | |
| SCHEMBL13503274 | 0.83 | CYP3A4 (0.46) | RAPGEF4TRPA1EGFRCYP1A2CYP2A6 | |
| SCHEMBL11596468 | 0.80 | MAPT (0.53) | NPC1RAB9ASMN1; SMN2ALDH1A1LMNA | |
| SCHEMBL13346008 | 0.79 | MEN1 (0.43) | TRPA1EGFRCYP1A2NPC1RAB9A | |
| SCHEMBL10144150 | 0.79 | AKR1C3 (0.56) | TRPA1CYP1A2PTGS1PTGS2LMNA | |
| SCHEMBL11593703 | 0.78 | EGFR (0.39) | RAPGEF4TRPA1EGFRCYP1A2CYP2A6 | |
| SCHEMBL21323167 | 0.78 | RAPGEF4 (0.37) | RAPGEF4TRPA1EGFRCYP1A2CYP2A6 | |
| SCHEMBL8767500 | 0.78 | SMN1; SMN2 (0.41) | RAPGEF4TRPA1EGFRCYP1A2PDE2A | |
| SCHEMBL1604988 | 0.77 | P2RX7 (0.43) | TRPA1CYP1A2CYP2A6NPC1RAB9A | |
| SCHEMBL29625809 | 0.77 | P2RX7 (0.43) | TRPA1CYP1A2CYP2A6NPC1RAB9A |
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-5648538-A | Process for preparing diarylamines from arylamines | FUSHUN RESEARCH INSTITUTE OF PETROLEUM AND PETROCHEMICALS (CN) | 1997-07-15 | — | — | US | disclosed |