Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | TYMP | P19971 | 3/20 | 0.39 |
| ▸ | CA12 | O43570 | 5/20 | 0.38 |
| ▸ | CA1 | P00915 | 5/20 | 0.38 |
| ▸ | CA2 | P00918 | 5/20 | 0.38 |
| ▸ | CA9 | Q16790 | 5/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.37 |
| ▸ | MITF | O75030 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | NOS1 | P29475 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Doranidazole SCHEMBL8279382 | 0.91 | KMT2A (0.47) | KMT2ALMNATHRBCYP2C19TYMP | |
| Doranidazole SCHEMBL8279381 | 0.91 | KMT2A (0.47) | KMT2ALMNATHRBCYP2C19TYMP | |
| Doranidazole SCHEMBL2840259 | 0.91 | KMT2A (0.47) | KMT2ALMNATHRBCYP2C19TYMP | |
| Doranidazole SCHEMBL7208974 | 0.91 | KMT2A (0.47) | KMT2ALMNATHRBCYP2C19TYMP | |
| Doranidazole SCHEMBL7201581 | 0.91 | KMT2A (0.47) | KMT2ALMNATHRBCYP2C19TYMP | |
| SCHEMBL9237087 | 0.90 | KMT2A (0.47) | KMT2ALMNATHRBCYP2C19TYMP | |
| SCHEMBL9975773 | 0.90 | KMT2A (0.47) | KMT2ALMNATHRBCYP2C19TYMP | |
| SCHEMBL17706714 | 0.86 | KMT2A (0.43) | KMT2ALMNATHRBCYP2C19TYMP | |
| SCHEMBL17706716 | 0.86 | KMT2A (0.43) | KMT2ALMNATHRBCYP2C19TYMP | |
| SCHEMBL27791575 | 0.85 | KMT2A (0.49) | KMT2ALMNATHRBCYP2C19TYMP |
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 |
|---|---|---|---|---|---|---|---|
| EP-2116241-A1 | PHARMACEUTICAL COMPOSITION | Pola Pharma Inc. (JP) | 2009-11-11 | — | — | EP | disclosed |