Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 1/20 | 0.47 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.45 |
| ▸ | MIF | P14174 | 4/20 | 0.43 |
| ▸ | MAOB | P27338 | 2/20 | 0.43 |
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
| ▸ | KDM1A | O60341 | 1/20 | 0.41 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.39 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.39 |
| ▸ | NTRK3 | Q16288 | 1/20 | 0.39 |
| ▸ | NTRK2 | Q16620 | 1/20 | 0.39 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.39 |
| ▸ | RXRA | P19793 | 1/20 | 0.39 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.39 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | CA2 | P00918 | 2/20 | 0.39 |
| ▸ | CA9 | Q16790 | 2/20 | 0.39 |
| ▸ | CA4 | P22748 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6532336 | 0.89 | NOTUM (0.47) | NOTUMSIGMAR1MIFMAOBMAOA | |
| SCHEMBL6528013 | 0.89 | NOTUM (0.46) | NOTUMSIGMAR1MIFMAOBMAOA | |
| SCHEMBL6505411 | 0.86 | MAOB (0.48) | NOTUMMIFMAOBMAOAKDM1A | |
| SCHEMBL6532331 | 0.83 | MAOB (0.44) | NOTUMSIGMAR1MAOBMAOAL3MBTL1 | |
| SCHEMBL5623581 | 0.81 | NOTUM (0.58) | NOTUMMIFMAOBMAOAKDM1A | |
| SCHEMBL6926057 | 0.81 | MIF (0.48) | NOTUMMIFKDM1AALKRXRA | |
| SCHEMBL5623649 | 0.80 | NOTUM (0.57) | NOTUMMIFMAOBMAOAKDM1A | |
| SCHEMBL6532001 | 0.79 | F10 (0.43) | NOTUMMIFALKNTRK1NTRK3 | |
| SCHEMBL14527043 | 0.79 | NOTUM (0.56) | NOTUMMIFMAOBMAOAKDM1A | |
| SCHEMBL6529489 | 0.79 | NOTUM (0.47) | NOTUMMIFMAOBMAOACA1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005082892-A2 | TRIAZOLE COMPOUNDS AS ANTIBACTERIAL AGENTS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | DR. REDDY'S LABORATORIES LTD. (IN) | 2005-09-09 | — | — | WO | disclosed |