Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | STAT3 | P40763 | 1/20 | 0.39 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.36 |
| ▸ | TAS2R46 | P59540 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | TERT | O14746 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | XBP1 | P17861 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL18981114 | 1.00 | CYP19A1 (0.40) | CYP19A1TDP1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL17147749 | 1.00 | CYP19A1 (0.40) | CYP19A1TDP1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL10192292 | 0.98 | CYP19A1 (0.41) | CYP19A1TDP1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL24299728 | 0.98 | CYP19A1 (0.41) | CYP19A1TDP1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8394084 | 0.94 | CYP19A1 (0.44) | CYP19A1TDP1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL17147745 | 0.76 | CYP19A1 (0.44) | CYP19A1TDP1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL12620335 | 0.75 | NLRP3 (0.42) | CYP19A1TDP1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL10933310 | 0.73 | CA1 (0.43) | CYP19A1TDP1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL11805630 | 0.73 | PRSS1 (0.36) | TDP1CYP2D6KMT2ALMNATP53 | |
| SCHEMBL20617569 | 0.73 | PRSS1 (0.36) | TDP1CYP2D6KMT2ALMNATP53 |
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 |
|---|---|---|---|---|---|---|---|
| US-20170174802-A1 | COPOLYMER AND MOLDED ARTICLE | KURARAY CO., LTD. (JP) | 2017-06-22 | — | — | US | disclosed |