Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 | P00519 | 2/20 | 0.43 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.43 |
| ▸ | BCR | P11274 | 2/20 | 0.43 |
| ▸ | ESR1 | P03372 | 7/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 7/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.35 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6630340 | 0.78 | ESR1 (0.45) | ABL1ABCB1BCRESR1ESR2 | |
| SCHEMBL68114 | 0.73 | CYP2A6 (0.42) | CYP1A2CYP3A4HSD17B10TDP1CA1 | |
| SCHEMBL29358095 | 0.71 | CYP1A2 (0.72) | ABL1ABCB1BCRESR1ESR2 | |
| SCHEMBL29711 | 0.71 | CYP1A2 (0.72) | ABL1ABCB1BCRESR1ESR2 | |
| SCHEMBL17311956 | 0.71 | CYP1A2 (0.72) | ABL1ABCB1BCRESR1ESR2 | |
| SCHEMBL11753900 | 0.70 | ESR1 (0.57) | ABL1ABCB1BCRESR1ESR2 | |
| SCHEMBL15756332 | 0.70 | CYP1A2 (0.50) | ABL1ABCB1BCRESR1ESR2 | |
| SCHEMBL6633295 | 0.70 | CYP1A2 (0.50) | ABL1ABCB1BCRESR1ESR2 | |
| SCHEMBL2700600 | 0.70 | CYP2A6 (0.39) | CYP1A2CYP3A4ALOX15HIF1AHSD17B10 | |
| SCHEMBL1557253 | 0.70 | CYP2A6 (0.39) | CYP1A2CYP3A4ALOX15HIF1AHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| US-RE39591-E1 | 6-O-substituted ketolides having antibacterial activity | ABBOTT LABORATORIES (US) | 2007-04-24 | — | — | US | claimed |
| US-RE39591-E1 | 6-O-substituted ketolides having antibacterial activity | ABBOTT LABORATORIES (US) | 2007-04-24 | — | — | US | disclosed |
| EP-1291351-B1 | 6-0 substituted ketolides having antibacterial activity | ABBOTT LAB (US) | 2005-07-13 | — | — | EP | disclosed |