Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MRGPRX1 | Q96LB2 | 3/20 | 0.46 |
| ▸ | PRSS1 | P07477 | 5/20 | 0.44 |
| ▸ | PRSS2 | P07478 | 5/20 | 0.44 |
| ▸ | PRSS3 | P35030 | 5/20 | 0.44 |
| ▸ | F10 | P00742 | 1/20 | 0.44 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.44 |
| ▸ | F2 | P00734 | 3/20 | 0.41 |
| ▸ | PLG | P00747 | 1/20 | 0.41 |
| ▸ | C1S | P09871 | 1/20 | 0.41 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.41 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | BRCA1 | P38398 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9030764 | 0.86 | MRGPRX1 (0.45) | MRGPRX1PRSS1PRSS2PRSS3F10 | |
| SCHEMBL8409513 | 0.79 | KMT2A (0.48) | PRSS1PRSS2PRSS3F10LOXL2 | |
| SCHEMBL9030595 | 0.78 | MRGPRX1 (0.46) | MRGPRX1PRSS1PRSS2PRSS3F10 | |
| SCHEMBL9030747 | 0.78 | PRSS1 (0.55) | MRGPRX1PRSS1PRSS2PRSS3F10 | |
| SCHEMBL9030039 | 0.78 | THRA (0.49) | MRGPRX1PRSS1PRSS2PRSS3F2 | |
| Hydrochloric Acid SCHEMBL8410206 | 0.76 | CYP2C19 (0.39) | PRSS1PRSS2PRSS3F10F2 | |
| SCHEMBL16489292 | 0.76 | PRSS1 (0.46) | PRSS1PRSS2PRSS3F10LOXL2 | |
| SCHEMBL9030515 | 0.76 | MRGPRX1 (0.47) | MRGPRX1PRSS1PRSS2PRSS3F2 | |
| SCHEMBL6652748 | 0.75 | KMT2A (0.41) | ALDH1A1LMNAPOLBRAB9ASMN1; SMN2 | |
| SCHEMBL8995527 | 0.74 | PRSS1 (0.55) | PRSS1PRSS2PRSS3F10LOXL2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0832076-A1 | NOVEL ISOXAZOLINE AND ISOXAZOLE FIBRINOGEN RECEPTOR ANTAGONISTS | THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) | 1998-04-01 | — | — | EP | disclosed |
| EP-0730590-A1 | NOVEL ISOXAZOLINE AND ISOXAZOLE FIBRINOGEN RECEPTOR ANTAGONISTS | THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) | 1996-09-11 | — | — | EP | disclosed |