Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | THRB | P10828 | 2/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.31 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.31 |
| ▸ | NQO1 | P15559 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
| ▸ | HTR2A | P28223 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL29958039 | 0.87 | L3MBTL1 (0.33) | ALDH1A1SMN1; SMN2LMNAGAAMAPT | |
| SCHEMBL2558885 | 0.82 | ALOX5AP (0.36) | HTTTUBB1TSHR | |
| SCHEMBL24707510 | 0.78 | SMN1; SMN2 (0.36) | ALDH1A1SMN1; SMN2LMNAGAATHRB | |
| SCHEMBL16687403 | 0.78 | HPGD (0.41) | ALDH1A1SMN1; SMN2LMNAGAAKMT2A | |
| SCHEMBL7147671 | 0.76 | THRB (0.37) | ALDH1A1SMN1; SMN2LMNAGAATHRB | |
| SCHEMBL31015943 | 0.76 | THRB (0.37) | ALDH1A1SMN1; SMN2LMNAGAATHRB | |
| SCHEMBL1069183 | 0.74 | L3MBTL1 (0.39) | ALDH1A1SMN1; SMN2HTTCYP1A2CYP2D6 | |
| SCHEMBL29952385 | 0.74 | L3MBTL1 (0.39) | ALDH1A1SMN1; SMN2HTTCYP1A2CYP2D6 | |
| SCHEMBL29187013 | 0.71 | L3MBTL1 (0.33) | ALDH1A1HTTL3MBTL1TUBB1NQO1 | |
| SCHEMBL3318185 | 0.71 | CA1 (0.31) | TSHR |
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-2560653-A1 | CERTAIN AMINO-PYRIMIDINES, COMPOSITIONS THEREOF, AND METHODS FOR THEIR USE | Cytokinetics, Inc. (US) | 2013-02-27 | — | — | EP | disclosed |
| WO-2011133888-A1 | CERTAIN AMINO-PYRIMIDINES, COMPOSITIONS THEREOF, AND METHODS FOR THEIR USE | CYTOKINETICS, INC. (US) | 2011-10-27 | — | — | WO | disclosed |