Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 5/20 | 0.59 |
| ▸ | NPC1 | O15118 | 3/20 | 0.59 |
| ▸ | EGFR | P00533 | 1/20 | 0.58 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.58 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.58 |
| ▸ | POLB | P06746 | 1/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.52 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.51 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL30445248 | 0.85 | RAB9A (0.59) | RAB9ANPC1EGFRMAPK1HSD17B10 | |
| SCHEMBL25174147 | 0.85 | RAB9A (0.59) | RAB9ANPC1EGFRMAPK1HSD17B10 | |
| SCHEMBL30444499 | 0.82 | RAB9A (0.66) | RAB9ANPC1POLBALDH1A1LOXL2 | |
| SCHEMBL694145 | 0.82 | RAB9A (0.66) | RAB9ANPC1POLBALDH1A1LOXL2 | |
| SCHEMBL27616133 | 0.82 | CYP4F2 (0.58) | RAB9ANPC1EGFRMAPK1HSD17B10 | |
| SCHEMBL134016 | 0.82 | EGFR (0.57) | RAB9ANPC1EGFRMAPK1HSD17B10 | |
| SCHEMBL8672958 | 0.82 | RAB9A (0.60) | RAB9ANPC1EGFRMAPK1HSD17B10 | |
| Hydrochloric Acid SCHEMBL1302781 | 0.81 | RAB9A (0.64) | RAB9ANPC1POLBALDH1A1LOXL2 | |
| SCHEMBL20096465 | 0.81 | RAB9A (0.59) | RAB9ANPC1EGFRMAPK1HSD17B10 | |
| SCHEMBL18392373 | 0.81 | HSD17B10 (0.56) | RAB9ANPC1EGFRMAPK1HSD17B10 |
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-2021119199-A1 | ALPHA-5 BETA-1 INHIBITORS | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2021-06-17 | — | — | WO | disclosed |