Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TBXAS1 | P24557 | 2/20 | 0.71 |
| ▸ | QPCT | Q16769 | 6/20 | 0.59 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.51 |
| ▸ | CA12 | O43570 | 1/20 | 0.50 |
| ▸ | CA1 | P00915 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
| ▸ | CA9 | Q16790 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.49 |
| ▸ | HTT | P42858 | 2/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | SOD1 | P00441 | 1/20 | 0.47 |
| ▸ | PRKCI | P41743 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL23746470 | 0.98 | TBXAS1 (0.74) | TBXAS1QPCTCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL28712305 | 0.98 | TBXAS1 (0.74) | TBXAS1QPCTCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL28720416 | 0.98 | TBXAS1 (0.74) | TBXAS1QPCTCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL28286843 | 0.95 | TBXAS1 (0.68) | TBXAS1QPCTCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL29109593 | 0.93 | TBXAS1 (0.71) | TBXAS1QPCTCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL28183410 | 0.92 | TBXAS1 (0.69) | TBXAS1QPCTCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL27150657 | 0.92 | TBXAS1 (0.69) | TBXAS1QPCTCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL13256613 | 0.91 | QPCT (0.65) | TBXAS1QPCTCYP1A2CYP3A4CYP2D6 | |
| Hydrochloric Acid SCHEMBL9021019 | 0.90 | QPCT (0.63) | TBXAS1QPCTCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL19786259 | 0.89 | TBXAS1 (0.68) | TBXAS1QPCTCYP1A2CYP3A4CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109476803-B | Amine compositions useful for making polyurethane foams | 赢创运营有限公司 | 2022-04-12 | — | — | CN | claimed |
| CN-109476803-B | Amine compositions useful for making polyurethane foams | 赢创运营有限公司 | 2022-04-12 | — | — | CN | disclosed |
| EP-1871375-B1 | CARBOLINE DERIVATIVES USEFUL IN THE TREATMENT OF CANCER | PTC THERAPEUTICS INC (US) | 2012-02-29 | — | — | EP | disclosed |