Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | TAS1R3 | Q7RTX0 | 2/20 | 0.48 |
| ▸ | TAS1R1 | Q7RTX1 | 2/20 | 0.48 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.48 |
| ▸ | TYK2 | P29597 | 4/20 | 0.48 |
| ▸ | JAK1 | P23458 | 3/20 | 0.48 |
| ▸ | JAK2 | O60674 | 3/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | ITGB1 | P05556 | 11/20 | 0.45 |
| ▸ | ITGA4 | P13612 | 11/20 | 0.45 |
| ▸ | ITGA2 | P17301 | 1/20 | 0.45 |
| ▸ | ITGB7 | P26010 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL5259497 | 0.88 | ITGB1 (0.49) | ITGB1ITGA4 | |
| SCHEMBL6511921 | 0.86 | KMT2A (0.53) | KMT2ATAS1R3TAS1R1TAS1R2TYK2 | |
| Trifluoroacetic Acid SCHEMBL6518249 | 0.81 | ITGB1 (0.48) | ITGB1ITGA4 | |
| SCHEMBL5257953 | 0.78 | ITGB1 (0.47) | ITGB1ITGA4 | |
| SCHEMBL3658423 | 0.76 | L3MBTL1 (0.46) | KMT2ACYP3A4MAPTRAB9A | |
| SCHEMBL1294954 | 0.76 | L3MBTL1 (0.46) | KMT2ACYP3A4MAPTRAB9A | |
| SCHEMBL391130 | 0.76 | L3MBTL1 (0.46) | KMT2ACYP3A4MAPTRAB9A | |
| SCHEMBL28097862 | 0.75 | JAK2 (0.51) | KMT2ATAS1R3TAS1R1TAS1R2TYK2 | |
| Hydrochloric Acid SCHEMBL391129 | 0.75 | L3MBTL1 (0.44) | KMT2ACYP3A4MAPTRAB9A | |
| Hydrochloric Acid SCHEMBL389435 | 0.75 | L3MBTL1 (0.44) | KMT2ACYP3A4MAPTRAB9A |
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-2006052962-A2 | BICYCLIC TRIAZOLE A4 INTEGRIN INHIBITORS | JANSSEN PHARMACEUTICA, N.V. (BE) | 2006-05-18 | — | — | WO | disclosed |