Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 2/20 | 0.34 |
| ▸ | CA2 | P00918 | 2/20 | 0.34 |
| ▸ | CA9 | Q16790 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 3/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.33 |
| ▸ | PDE4A | P27815 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28534089 | 0.72 | CA1 (0.37) | CA1CA2CA9LMNACYP2C9 | |
| SCHEMBL3391648 | 0.70 | CA1 (0.35) | CYP3A4TSHRALDH1A1TP53TDP1 | |
| SCHEMBL19693189 | 0.69 | CA1 (0.39) | CA1CA2CA9LMNACYP2C9 | |
| SCHEMBL22197813 | 0.69 | ALDH1A1 (0.47) | CYP3A4TSHRALDH1A1TP53TDP1 | |
| SCHEMBL2265260 | 0.69 | TPMT (0.31) | — | |
| SCHEMBL18725004 | 0.69 | TTR (0.30) | — | |
| SCHEMBL526416 | 0.69 | ALDH1A1 (0.47) | CYP3A4TSHRALDH1A1TP53TDP1 | |
| SCHEMBL16071017 | 0.69 | CD44 (0.44) | CYP3A4TSHRALDH1A1TP53TDP1 | |
| SCHEMBL20870505 | 0.68 | ALDH1A1 (0.52) | CYP3A4TSHRALDH1A1TP53TDP1 | |
| SCHEMBL6624352 | 0.68 | KDM4E (0.45) | CYP3A4TSHRALDH1A1TP53TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1968635-B1 | Compositions containing, methods involving, and uses of non-natural amino acids and polypeptides | AMBRX INC (US) | 2014-09-17 | — | — | EP | disclosed |