Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.48 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.44 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.44 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.42 |
| ▸ | TNNC1 | P63316 | 1/20 | 0.40 |
| ▸ | DHFR | P00374 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | MAOB | P27338 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5033239 | 0.80 | TNNC1 (0.50) | ALOX5PTGS1PTGS2TUBB1TNNC1 | |
| SCHEMBL8325852 | 0.79 | NFE2L2 (0.45) | TAAR1ALOX5PTGS1PTGS2KMT2A | |
| SCHEMBL9131824 | 0.79 | ALOX5 (0.50) | TAAR1ALOX5PTGS1PTGS2TUBB1 | |
| SCHEMBL9131838 | 0.79 | ALOX5 (0.50) | TAAR1ALOX5PTGS1PTGS2TUBB1 | |
| SCHEMBL7232801 | 0.78 | ALOX5 (0.43) | TAAR1ALOX5PTGS1PTGS2TUBB1 | |
| SCHEMBL7236078 | 0.78 | TNNC1 (0.46) | TAAR1ALOX5PTGS1PTGS2TUBB1 | |
| SCHEMBL7232803 | 0.78 | ALOX5 (0.43) | TAAR1ALOX5PTGS1PTGS2TUBB1 | |
| SCHEMBL7236072 | 0.78 | TNNC1 (0.46) | TAAR1ALOX5PTGS1PTGS2TUBB1 | |
| SCHEMBL9026432 | 0.78 | ALOX5 (0.63) | TAAR1ALOX5PTGS1PTGS2TUBB1 | |
| SCHEMBL16853122 | 0.78 | ALOX5 (0.63) | TAAR1ALOX5PTGS1PTGS2TUBB1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004071445-A2 | 2-(AMINOMETHYL)ARYLAMIDE ANALGESICS | PHARMACOPEIA DRUG DISCOVERY, INC. (US) | 2004-08-26 | — | — | WO | disclosed |