Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR1 | O14842 | 4/20 | 0.57 |
| ▸ | ITGB1 | P05556 | 12/20 | 0.56 |
| ▸ | ITGA4 | P13612 | 11/20 | 0.56 |
| ▸ | ITGA2 | P17301 | 1/20 | 0.56 |
| ▸ | ITGB7 | P26010 | 1/20 | 0.56 |
| ▸ | JAK2 | O60674 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.55 |
| ▸ | JAK1 | P23458 | 1/20 | 0.55 |
| ▸ | TYK2 | P29597 | 1/20 | 0.55 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.55 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.55 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.54 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.53 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.52 |
| ▸ | ITGAV | P06756 | 1/20 | 0.52 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.52 |
| ▸ | ITGB5 | P18084 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL6514115 | 0.86 | ITGB1 (0.65) | FFAR1ITGB1ITGA4NR1H4 | |
| SCHEMBL28097862 | 0.85 | JAK2 (0.51) | ITGB1ITGA4ITGA2ITGB7JAK2 | |
| SCHEMBL6601710 | 0.81 | TYK2 (0.61) | ITGB1ITGA4ITGA2ITGB7JAK2 | |
| SCHEMBL6930314 | 0.81 | TYK2 (0.54) | FFAR1ITGB1ITGA4ITGA2ITGB7 | |
| SCHEMBL5660001 | 0.79 | LMNA (0.63) | FFAR1NR1H4 | |
| SCHEMBL27515653 | 0.79 | ITGB1 (0.64) | ITGB1ITGA4ITGA2ITGB7ITGB3 | |
| SCHEMBL5230799 | 0.79 | ITGB1 (0.64) | ITGB1ITGA4ITGA2ITGB7ITGB3 | |
| SCHEMBL4154853 | 0.79 | TYK2 (0.71) | JAK2CYP3A4JAK1TYK2TAS1R3 | |
| SCHEMBL27581014 | 0.79 | FFAR1 (0.59) | FFAR1NR1H4 | |
| SCHEMBL1232960 | 0.78 | NR1H4 (0.71) | FFAR1ITGB1KMT2ANR1H4ITGB3 |
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 |
|---|---|---|---|---|---|---|---|
| CN-104023751-B | Targeted delivery extremely expresses the integrin antagonists conjugate of the cell of VLA-4 | 弗·哈夫曼-拉罗切有限公司 | 2016-11-09 | — | — | CN | disclosed |