Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 5/20 | 0.53 |
| ▸ | ABL1 | P00519 | 11/20 | 0.52 |
| ▸ | PIM1 | P11309 | 1/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL14097445 | 0.87 | ABL1 (0.58) | ABL1 | |
| SCHEMBL14097499 | 0.84 | ABL1 (0.63) | ABL1 | |
| SCHEMBL14097430 | 0.84 | ABL1 (0.63) | ABL1MAPK1 | |
| SCHEMBL14097436 | 0.83 | ABL1 (0.51) | ABL1MAPK1 | |
| SCHEMBL14097405 | 0.83 | ABL1 (0.57) | ABL1 | |
| SCHEMBL14097512 | 0.83 | ABL1 (0.50) | ABL1 | |
| SCHEMBL14097569 | 0.83 | KMT2A (0.49) | ABL1MAPK1 | |
| SCHEMBL14097422 | 0.81 | ABL1 (0.55) | ABL1 | |
| SCHEMBL14097574 | 0.81 | ABL1 (0.59) | ABL1 | |
| SCHEMBL14097429 | 0.80 | ABL1 (0.59) | ABL1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7414046-B2 | Gyrase inhibitors and uses thereof | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2008-08-19 | — | — | US | disclosed |
| US-7414046-B2 | Gyrase inhibitors and uses thereof | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2008-08-19 | — | — | US | disclosed |
| US-RE40245-E1 | Gyrase inhibitors and uses thereof | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2008-04-15 | — | — | US | disclosed |
| US-RE40245-E1 | Gyrase inhibitors and uses thereof | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2008-04-15 | — | — | US | disclosed |