Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | G6PD | P11413 | 2/20 | 0.69 |
| ▸ | CYP19A1 | P11511 | 10/20 | 0.61 |
| ▸ | HSD17B3 | P37058 | 2/20 | 0.44 |
| ▸ | GPBAR1 | Q8TDU6 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | SHBG | P04278 | 2/20 | 0.42 |
| ▸ | SERPINA6 | P08185 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8528354 | 1.00 | G6PD (0.69) | G6PDCYP19A1HSD17B3GPBAR1LMNA | |
| SCHEMBL5961150 | 1.00 | G6PD (0.69) | G6PDCYP19A1HSD17B3GPBAR1LMNA | |
| SCHEMBL8640096 | 1.00 | G6PD (0.69) | G6PDCYP19A1HSD17B3GPBAR1LMNA | |
| SCHEMBL502481 | 0.85 | CYP19A1 (0.63) | G6PDCYP19A1HSD17B3GPBAR1LMNA | |
| SCHEMBL502482 | 0.85 | CYP19A1 (0.63) | G6PDCYP19A1HSD17B3GPBAR1LMNA | |
| SCHEMBL502634 | 0.85 | CYP19A1 (0.63) | G6PDCYP19A1HSD17B3GPBAR1LMNA | |
| SCHEMBL15094423 | 0.85 | CYP19A1 (0.63) | G6PDCYP19A1HSD17B3GPBAR1LMNA | |
| SCHEMBL5312818 | 0.84 | CYP19A1 (0.61) | G6PDCYP19A1HSD17B3GPBAR1LMNA | |
| SCHEMBL502992 | 0.84 | CYP19A1 (0.61) | G6PDCYP19A1HSD17B3GPBAR1LMNA | |
| SCHEMBL503217 | 0.84 | CYP19A1 (0.61) | G6PDCYP19A1HSD17B3GPBAR1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| US-5028631-A | Anticancer, antiobesity, anticholesterol | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 1991-07-02 | — | — | US | disclosed |