Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 2/20 | 0.53 |
| ▸ | HPGD | P15428 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL6894769 | 1.00 | CHRM2 (0.53) | CHRM2HPGDALDH1A1TAAR1KMT2A | |
| SCHEMBL40401 | 0.80 | CHRM2 (0.69) | CHRM2HPGDALDH1A1TAAR1KMT2A | |
| SCHEMBL606716 | 0.78 | CHRM2 (0.55) | CHRM2HPGDALDH1A1TAAR1KMT2A | |
| Hydrochloric Acid SCHEMBL6065696 | 0.78 | CHRM2 (0.67) | CHRM2HPGDALDH1A1TAAR1KMT2A | |
| SCHEMBL4582835 | 0.78 | CHRM2 (0.55) | CHRM2HPGDALDH1A1TAAR1KMT2A | |
| SCHEMBL24170552 | 0.76 | CHRM2 (0.53) | CHRM2HPGDALDH1A1TAAR1KMT2A | |
| SCHEMBL4189053 | 0.76 | CHRM2 (0.53) | CHRM2HPGDALDH1A1TAAR1KMT2A | |
| SCHEMBL8014820 | 0.76 | CHRM2 (0.53) | CHRM2HPGDALDH1A1TAAR1KMT2A | |
| SCHEMBL6784532 | 0.76 | ALDH1A1 (0.53) | CHRM2HPGDALDH1A1TAAR1KMT2A | |
| SCHEMBL9995162 | 0.76 | CHRM2 (0.53) | CHRM2HPGDALDH1A1TAAR1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-1126833-A4 | OXADIAZOLE, THIADIAZOLE AND TRIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF | TREGA BIOSCIENCES INC (US) | 2004-09-08 | — | — | EP | claimed |
| EP-1126833-A2 | OXADIAZOLE, THIADIAZOLE AND TRIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF | TREGA BIOSCIENCES, INC. (US) | 2001-08-29 | — | — | EP | claimed |
| WO-2000025768-A1 | OXADIAZOLE, THIADIAZOLE AND TRIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF | TREGA BIOSCIENCES, INC. (US) | 2000-05-11 | — | — | WO | claimed |