Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | POLB | P06746 | 3/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 4/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | ABL1 | P00519 | 1/20 | 0.40 |
| ▸ | RIN1 | Q13671 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | NOS3 | P29474 | 1/20 | 0.38 |
| ▸ | NOS2 | P35228 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL1189317 | 0.80 | ALDH1A1 (0.56) | ALDH1A1KDM4ESMN1; SMN2POLBHTT | |
| SCHEMBL952887 | 0.79 | ALDH1A1 (0.46) | ALDH1A1KDM4ESMN1; SMN2POLBHTT | |
| SCHEMBL953281 | 0.77 | ALDH1A1 (0.41) | ALDH1A1KDM4ESMN1; SMN2POLBHTT | |
| SCHEMBL12156720 | 0.77 | ALDH1A1 (0.56) | ALDH1A1KDM4ESMN1; SMN2POLBHTT | |
| SCHEMBL28139976 | 0.76 | CA2 (0.36) | SMN1; SMN2 | |
| SCHEMBL10985089 | 0.74 | ALDH1A1 (0.72) | ALDH1A1KDM4ESMN1; SMN2POLBHTT | |
| SCHEMBL1684895 | 0.74 | — | — | |
| SCHEMBL4036336 | 0.73 | KMT2A (0.47) | ALDH1A1SMN1; SMN2POLBGAAMAPT | |
| SCHEMBL1087959 | 0.72 | SMN1; SMN2 (0.47) | ALDH1A1KDM4ESMN1; SMN2POLBHTT | |
| SCHEMBL4034044 | 0.72 | GAA (0.61) | ALDH1A1HTTGAARECQLTSHR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2079711-A2 | 2-PHENYL-6-AMINOCARBONYL-PYRIMIDINE DERIVATIVES AND THEIR USE AS P2Y12 RECEPTOR ANTAGONISTS | Actelion Pharmaceuticals Ltd. (CH) | 2009-07-22 | — | — | EP | disclosed |
| WO-2008050301-A2 | 2- PHENYL- 6-AMINOCARBONYL- PYRIMIDINE DERIVATIVES AND THEIR USE AS P2Y12 RECEPTOR ANTAGONISTS | ACTELION PHARMACEUTICALS LTD (CH) | 2008-05-02 | — | — | WO | disclosed |