Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.58 |
| ▸ | PNMT | P11086 | 1/20 | 0.53 |
| ▸ | IDO1 | P14902 | 2/20 | 0.47 |
| ▸ | PTGES2 | Q9H7Z7 | 2/20 | 0.43 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | CD38 | P28907 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | PTPRC | P08575 | 1/20 | 0.37 |
| ▸ | PTPRG | P23470 | 1/20 | 0.37 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6011891 | 0.81 | TAAR1 (0.53) | TAAR1PNMTIDO1PTGES2AKR1B1 | |
| SCHEMBL9390698 | 0.81 | PNMT (0.57) | TAAR1PNMTIDO1PTGES2AKR1B1 | |
| SCHEMBL10690855 | 0.74 | TAAR1 (0.63) | TAAR1PNMTIDO1RECQLKDM4E | |
| SCHEMBL1570973 | 0.74 | TAAR1 (1.00) | TAAR1PNMTIDO1 | |
| SCHEMBL30785390 | 0.74 | TAAR1 (1.00) | TAAR1PNMTIDO1 | |
| SCHEMBL1462274 | 0.74 | TAAR1 (0.37) | TAAR1PNMTPTGES2RECQLALDH1A1 | |
| SCHEMBL25435653 | 0.71 | TAAR1 (0.57) | TAAR1IDO1AKR1B1RECQLTSHR | |
| SCHEMBL27737597 | 0.71 | RECQL (0.42) | TAAR1PNMTPTGES2RECQLCA1 | |
| SCHEMBL2907991 | 0.71 | PNMT (0.54) | TAAR1PNMTIDO1AKR1B1KDM4E | |
| SCHEMBL10914706 | 0.71 | TAAR1 (0.77) | TAAR1PNMTIDO1KDM4EALDH1A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1942888-A2 | CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS | Cytokinetics, Inc. (US) | 2008-07-16 | — | — | EP | claimed |
| WO-2007056078-A2 | CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS | CYTOKINETICS, INC. (US) | 2007-05-18 | — | — | WO | claimed |
| EP-1942888-A2 | CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS | Cytokinetics, Inc. (US) | 2008-07-16 | — | — | EP | disclosed |
| WO-2007056078-A2 | CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS | CYTOKINETICS, INC. (US) | 2007-05-18 | — | — | WO | disclosed |