Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NTRK1 | P04629 | 1/20 | 0.33 |
| ▸ | NTRK3 | Q16288 | 1/20 | 0.33 |
| ▸ | NTRK2 | Q16620 | 1/20 | 0.33 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.33 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.33 |
| ▸ | MIF | P14174 | 3/20 | 0.32 |
| ▸ | CA1 | P00915 | 3/20 | 0.32 |
| ▸ | CA2 | P00918 | 3/20 | 0.32 |
| ▸ | CA9 | Q16790 | 3/20 | 0.32 |
| ▸ | CA12 | O43570 | 2/20 | 0.32 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.32 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.32 |
| ▸ | TUBB4A | P04350 | 3/20 | 0.32 |
| ▸ | TUBB | P07437 | 3/20 | 0.32 |
| ▸ | TUBA3C | P0DPH7 | 3/20 | 0.32 |
| ▸ | HDAC4 | P56524 | 3/20 | 0.32 |
| ▸ | TUBA1B | P68363 | 3/20 | 0.32 |
| ▸ | TUBA4A | P68366 | 3/20 | 0.32 |
| ▸ | TUBB4B | P68371 | 3/20 | 0.32 |
| ▸ | TUBB3 | Q13509 | 3/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6527377 | 0.94 | HPGD (0.31) | NTRK1NTRK3NTRK2NOTUMMIF | |
| SCHEMBL6530108 | 0.93 | CAPN1 (0.32) | NOTUMMIFCAPN1HDAC3TUBB4A | |
| SCHEMBL6527389 | 0.87 | NOTUM (0.34) | NOTUMMIFCA1CA2CA9 | |
| SCHEMBL6533849 | 0.84 | CAPN1 (0.33) | NOTUMMIFCAPN1HDAC3TUBB4A | |
| SCHEMBL6527807 | 0.82 | NOTUM (0.38) | ALKNOTUMMIFCA1CA2 | |
| SCHEMBL6528430 | 0.81 | NOTUM (0.37) | ALKNOTUMMIFCA1CA2 | |
| SCHEMBL6529698 | 0.81 | MIF (0.38) | NTRK1NTRK3NTRK2ALKNOTUM | |
| SCHEMBL6531446 | 0.81 | NOTUM (0.37) | ALKNOTUMMIFCA1CA2 | |
| SCHEMBL6510881 | 0.80 | CA1 (0.43) | CA1CA2CA9CA12KDM1A | |
| SCHEMBL6528709 | 0.79 | NOTUM (0.42) | ALKNOTUMMIFCA1CA2 |
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 |