Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 10/20 | 0.47 |
| ▸ | ABCC9 | O60706 | 8/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | ABCC8 | Q09428 | 2/20 | 0.42 |
| ▸ | KCNJ11 | Q14654 | 2/20 | 0.42 |
| ▸ | KCNJ8 | Q15842 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9301353 | 1.00 | ABCB1 (0.47) | ABCB1ABCC9CYP3A4ALOX15ABCC8 | |
| SCHEMBL9301349 | 1.00 | ABCB1 (0.47) | ABCB1ABCC9CYP3A4ALOX15ABCC8 | |
| SCHEMBL9299953 | 0.92 | CYP3A4 (0.44) | ABCB1ABCC9CYP3A4ALOX15ABCC8 | |
| SCHEMBL9299947 | 0.92 | CYP3A4 (0.44) | ABCB1ABCC9CYP3A4ALOX15ABCC8 | |
| SCHEMBL9299943 | 0.92 | CYP3A4 (0.44) | ABCB1ABCC9CYP3A4ALOX15ABCC8 | |
| SCHEMBL9300563 | 0.87 | ABCB1 (0.52) | ABCB1ABCC9CYP3A4ALOX15ABCC8 | |
| SCHEMBL9300570 | 0.87 | ABCB1 (0.52) | ABCB1ABCC9CYP3A4ALOX15ABCC8 | |
| SCHEMBL9300566 | 0.87 | ABCB1 (0.52) | ABCB1ABCC9CYP3A4ALOX15ABCC8 | |
| SCHEMBL9299817 | 0.84 | ABCC9 (0.54) | ABCB1ABCC9CYP3A4ALOX15ABCC8 | |
| SCHEMBL9299811 | 0.84 | ABCC9 (0.54) | ABCB1ABCC9CYP3A4ALOX15ABCC8 |
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-5296492-A | Certain chroman derivatives useful for treating symptoms caused by contraction of smooth muscles, circulatory diseases or epilepsy | NIPPON KAYAKU KABUSHIKI KAISHA (JP) | 1994-03-22 | — | — | US | disclosed |