Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.31 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.30 |
| ▸ | HTT | P42858 | 2/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | ALOX5 | P09917 | 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 | |
|---|---|---|---|---|
| SCHEMBL13886805 | 0.84 | TDP1 (0.36) | TDP1TP53RAPGEF4HPGDCYP3A4 | |
| SCHEMBL14100633 | 0.82 | TDP1 (0.38) | TDP1TP53RAPGEF4HPGDSMN1; SMN2 | |
| SCHEMBL19432185 | 0.80 | TDP1 (0.36) | TDP1TP53RAPGEF4HPGDMEN1 | |
| SCHEMBL7790391 | 0.80 | SRC (0.43) | RAPGEF4HPGDMEN1KMT2AALDH1A1 | |
| SCHEMBL20161244 | 0.77 | CYP3A4 (0.38) | TDP1TP53RAPGEF4HPGDCYP3A4 | |
| SCHEMBL14201220 | 0.76 | TRPA1 (0.34) | HPGDSMN1; SMN2ALDH1A1CYP1A2CYP2A6 | |
| SCHEMBL5084622 | 0.73 | TDP1 (0.44) | TDP1TP53HPGDCYP3A4THRB | |
| SCHEMBL21312635 | 0.73 | RAPGEF4 (0.41) | TDP1TP53RAPGEF4SMN1; SMN2MEN1 | |
| SCHEMBL13363012 | 0.72 | TDP1 (0.52) | TDP1TP53CYP3A4THRBALOX15 | |
| SCHEMBL21323393 | 0.72 | UTS2R (0.43) | TDP1CYP3A4ALDH1A1CYP1A2CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018132279-A1 | TGF BETA RECEPTOR ANTAGONISTS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2018-07-19 | — | — | WO | disclosed |
| WO-2018017633-A1 | TGF Beta RECEPTOR ANTAGONISTS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2018-01-25 | — | — | WO | disclosed |
| EP-1465900-B1 | RHO-KINASE INHIBITORS | BAYER HEALTHCARE AG (DE) | 2008-05-14 | — | — | EP | disclosed |