Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 4/20 | 0.34 |
| ▸ | CA2 | P00918 | 4/20 | 0.34 |
| ▸ | CA9 | Q16790 | 4/20 | 0.34 |
| ▸ | CA12 | O43570 | 3/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | ELANE | P08246 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.30 |
| ▸ | BCHE | P06276 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | THRB | P10828 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL7155657 | 0.76 | POLB (0.36) | CA1CA2CA9CYP3A4POLB | |
| SCHEMBL9694551 | 0.76 | POLB (0.36) | CYP3A4POLBGAACYP2D6 | |
| SCHEMBL1009073 | 0.72 | POLB (0.38) | CA1CA2CA9CYP3A4POLB | |
| SCHEMBL20068287 | 0.71 | ALDH1A1 (0.33) | CA1CA2CA9CA12POLB | |
| SCHEMBL20799299 | 0.67 | POLB (0.35) | CYP3A4POLBTSHRBCHECYP2D6 | |
| SCHEMBL18946815 | 0.67 | POLB (0.35) | CYP3A4POLBTSHRBCHECYP2D6 | |
| SCHEMBL24145355 | 0.66 | POLB (0.38) | CA1CA2CA9CA12CYP3A4 | |
| SCHEMBL220405 | 0.66 | POLB (0.38) | CA1CA2CA9CA12CYP3A4 | |
| SCHEMBL17928956 | 0.66 | POLB (0.38) | CA1CA2CA9CA12CYP3A4 | |
| SCHEMBL6475002 | 0.66 | POLB (0.38) | CA1CA2CA9CA12CYP3A4 |
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-4203976-A | ANTHELMINTICS, INSECTICIDES, PARASITICIDES, MITICIDES | MERCK & CO., INC. (US) | 1980-05-20 | — | — | US | disclosed |