Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.41 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.41 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.41 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.41 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL19573888 | 0.89 | KMT2A (0.45) | ATMGAACYP3A4LMNAALDH1A1 | |
| SCHEMBL16119698 | 0.84 | ATM (0.48) | ATMGAATAAR1CYP1A2CYP3A4 | |
| SCHEMBL12627891 | 0.82 | LMNA (0.52) | ATMGAACYP1A2CYP2C19LMNA | |
| SCHEMBL5480782 | 0.82 | ATM (0.56) | ATMCYP1A2CYP3A4CYP2C19PKM | |
| SCHEMBL21222487 | 0.81 | HPGD (0.51) | GAALMNAALDH1A1KMT2AL3MBTL1 | |
| SCHEMBL24834185 | 0.77 | ATM (0.48) | ATMGAATAAR1CYP1A2CYP3A4 | |
| SCHEMBL11142783 | 0.77 | ATM (0.45) | ATMGAACYP1A2CYP3A4CYP2C19 | |
| SCHEMBL11664862 | 0.75 | TAAR1 (0.49) | ATMTAAR1CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL15484253 | 0.75 | HPGD (0.51) | GAACYP3A4LMNAALDH1A1KMT2A | |
| SCHEMBL15883199 | 0.75 | ALDH1A1 (0.55) | ATMTAAR1CYP1A2CYP3A4CYP2C19 |
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-2018069863-A1 | 1,3 DI-SUBSTITUTED CYCLOBUTANE OR AZETIDINE DERIVATIVES AS HEMATOPOIETIC PROSTAGLANDIN D SYNTHASE INHIBITORS | GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) | 2018-04-19 | — | — | WO | disclosed |