Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 3/20 | 0.53 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.52 |
| ▸ | RAB9A | P51151 | 1/20 | 0.52 |
| ▸ | ERN1 | O75460 | 7/20 | 0.51 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.49 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | ALDH5A1 | P51649 | 3/20 | 0.43 |
| ▸ | ABAT | P80404 | 3/20 | 0.43 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.43 |
| ▸ | AOX1 | Q06278 | 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 | |
|---|---|---|---|---|
| SCHEMBL10331755 | 0.81 | KDM4E (0.55) | ESR1ESR2KDM4EPTGS2RAB9A | |
| SCHEMBL4362335 | 0.79 | ESR1 (0.53) | ESR1ESR2KDM4EPTGS2RAB9A | |
| SCHEMBL18998873 | 0.79 | KDM4E (0.52) | ESR1ESR2KDM4EPTGS2RAB9A | |
| SCHEMBL10827942 | 0.79 | ESR1 (0.54) | ESR1ESR2KDM4EPTGS2RAB9A | |
| SCHEMBL4358501 | 0.79 | ESR1 (0.53) | ESR1ESR2KDM4EPTGS2RAB9A | |
| SCHEMBL9127399 | 0.78 | CYP2A6 (0.48) | KDM4EPTGS2RAB9AERN1ALDH1A1 | |
| SCHEMBL11809502 | 0.76 | ERN1 (0.56) | KDM4EPTGS2RAB9AERN1ALDH1A1 | |
| SCHEMBL9623620 | 0.75 | ESR1 (0.72) | ESR1ESR2ERN1HSD17B1HSD17B2 | |
| SCHEMBL50832 | 0.75 | ESR1 (0.61) | ESR1ESR2KDM4EERN1HSD17B1 | |
| SCHEMBL30570998 | 0.75 | ESR1 (0.72) | ESR1ESR2ERN1HSD17B1HSD17B2 |
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-5482968-A | ENZYME INHIBITORS, HYPOGLYCEMIC AGENTS AND VASCULAR AGENTS | AMERICAN HOME PRODUCTS CORPORATION (US) | 1996-01-09 | — | — | US | disclosed |
| US-5399588-A | Diabetes treatment | AMERICAN HOME PRODUCTS CORPORATION (US) | 1995-03-21 | — | — | US | disclosed |