Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 1/20 | 0.43 |
| ▸ | BRD4 | O60885 | 3/20 | 0.42 |
| ▸ | BRD9 | Q9H8M2 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | NAMPT | P43490 | 2/20 | 0.41 |
| ▸ | NTRK1 | P04629 | 2/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.41 |
| ▸ | FLT1 | P17948 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | BCHE | P06276 | 1/20 | 0.40 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA7 | P43166 | 1/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL5492718 | 0.84 | BCHE (0.40) | IDO1POLBNAMPTNTRK1SIGMAR1 | |
| SCHEMBL16118399 | 0.83 | CCNC (0.40) | IDO1CYP3A4POLBNTRK1BCHE | |
| SCHEMBL20540427 | 0.80 | CCNC (0.37) | BRD9POLBNAMPTNTRK1HDAC1 | |
| SCHEMBL5493771 | 0.77 | CCNC (0.41) | IDO1POLBNTRK1BCHECA12 | |
| SCHEMBL3106076 | 0.76 | AKT1 (0.37) | IDO1CYP3A4NTRK1SIGMAR1BCHE | |
| SCHEMBL5497817 | 0.73 | CCNC (0.46) | CYP3A4CA12CA1ALDH1A1GAA | |
| SCHEMBL5500423 | 0.73 | IDO1 (0.44) | IDO1CYP3A4SIGMAR1BCHEGAA | |
| SCHEMBL6427256 | 0.72 | BCHE (0.35) | IDO1SIGMAR1BCHEGAAMALT1 | |
| SCHEMBL28407540 | 0.72 | IDO1 (0.36) | IDO1CYP3A4POLBNAMPTNTRK1 | |
| SCHEMBL3838871 | 0.72 | CA12 (0.63) | IDO1NAMPTHDAC1CA12CA1 |
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-9006421-B2 | Cephalosporin compositions and methods of manufacture | CUBIST PHARMACEUTICALS, INC. (US) | 2015-04-14 | — | — | US | disclosed |