Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H3 | Q13133 | 6/20 | 0.44 |
| ▸ | CA12 | O43570 | 2/20 | 0.42 |
| ▸ | CA9 | Q16790 | 2/20 | 0.42 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.41 |
| ▸ | NR1H2 | P55055 | 5/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | ABCC9 | O60706 | 1/20 | 0.38 |
| ▸ | ABCC8 | Q09428 | 1/20 | 0.38 |
| ▸ | KCNJ11 | Q14654 | 1/20 | 0.38 |
| ▸ | KCNJ8 | Q15842 | 1/20 | 0.38 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.37 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3680524 | 0.83 | NR1H3 (0.42) | NR1H3CA12CA9MCOLN3NR1H2 | |
| SCHEMBL674238 | 0.78 | NR1H3 (0.41) | NR1H3CA12CA9MCOLN3NR1H2 | |
| SCHEMBL25137428 | 0.78 | CA12 (0.55) | NR1H3CA12CA9MCOLN3KDM4E | |
| Lithium SCHEMBL31041149 | 0.76 | CA12 (0.53) | NR1H3CA12CA9MCOLN3KDM4E | |
| SCHEMBL11829848 | 0.75 | POLB (0.40) | NR1H3CA12CA9MCOLN3NR1H2 | |
| SCHEMBL25137433 | 0.74 | CA12 (0.52) | NR1H3CA12CA9MCOLN3KDM4E | |
| SCHEMBL9888504 | 0.73 | NR1H3 (0.49) | NR1H3CA12CA9MCOLN3NR1H2 | |
| SCHEMBL9295422 | 0.70 | NR1H3 (0.40) | NR1H3CA12CA9MCOLN3NR1H2 | |
| SCHEMBL21034450 | 0.70 | CA12 (0.52) | NR1H3CA12CA9MCOLN3NR1H2 | |
| SCHEMBL5228279 | 0.70 | CA12 (0.52) | NR1H3CA12CA9MCOLN3KDM4E |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5741483-A | SYNERGISTIC MIXTURE OF ISOTHIAZOLINE-3-ONE, BENZODIOXOLE, ANDCHLORO ETHER DERIVATIVES | ROHM AND HAAS COMPANY (US) | 1998-04-21 | — | — | US | disclosed |
| EP-0745325-A2 | Industrial preservative anti-fungal composition and underwater antifouling composition | ROHM AND HAAS COMPANY (US) | 1996-12-04 | — | — | EP | disclosed |