Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | XPO1 | O14980 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL17350020 | 0.76 | CA12 (0.41) | XPO1CYP3A4CYP2C19HSD17B10 | |
| Asperlin SCHEMBL8418444 | 0.75 | CA12 (0.38) | XPO1CYP3A4CYP2C19HSD17B10 | |
| Asperlin SCHEMBL8418886 | 0.75 | CA12 (0.38) | XPO1CYP3A4CYP2C19HSD17B10 | |
| Asperlin SCHEMBL4618 | 0.75 | CA12 (0.38) | XPO1CYP3A4CYP2C19HSD17B10 | |
| Asperlin SCHEMBL34463245 | 0.75 | CA12 (0.38) | XPO1CYP3A4CYP2C19HSD17B10 | |
| Phomopsolide B SCHEMBL9474278 | 0.73 | XPO1 (0.34) | XPO1 | |
| Phomopsolide B SCHEMBL10028462 | 0.73 | XPO1 (0.34) | XPO1 | |
| Phomopsolide A SCHEMBL9475388 | 0.72 | XPO1 (0.39) | XPO1 | |
| SCHEMBL8420175 | 0.71 | CYP3A4 (0.42) | CYP3A4CYP2C19HSD17B10 | |
| SCHEMBL21339578 | 0.70 | POLB (0.34) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5912266-A | 6,7-ANHYDRO-2,3,8-TRIDEOXY-D-GALACTO-OCT-2-ENOIC ACID.DELTA.-LACTONE 4-ACETATE, ALSO REFERRED TO AS 5,6-DIHYDRO-5(S)-ACETOXY-6(S)-(1,2-TRANS-EPOXYPROPYL)-2H-PYRAN -2-ON. | AMERICAN HOME PRODUCTS CORPORATION (US) | 1999-06-15 | — | — | US | disclosed |
| WO-1998007432-A1 | BETA2 INTEGRIN CELL ADHESION MOLECULE INHIBITORS | AMERICAN HOME PRODUCTS CORPORATION (US) | 1998-02-26 | — | — | WO | disclosed |