Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B1 | P14061 | 3/20 | 0.53 |
| ▸ | HSD17B2 | P37059 | 3/20 | 0.53 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | JAK2 | O60674 | 1/20 | 0.50 |
| ▸ | JAK3 | P52333 | 1/20 | 0.50 |
| ▸ | CA12 | O43570 | 3/20 | 0.49 |
| ▸ | CA1 | P00915 | 3/20 | 0.49 |
| ▸ | CA2 | P00918 | 3/20 | 0.49 |
| ▸ | CA7 | P43166 | 3/20 | 0.49 |
| ▸ | CA9 | Q16790 | 3/20 | 0.49 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.49 |
| ▸ | ESR1 | P03372 | 1/20 | 0.49 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | HPGDS | O60760 | 1/20 | 0.45 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.44 |
| ▸ | FYN | P06241 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL29596804 | 0.86 | NPC1 (0.52) | NPC1RAB9ATP53MAPT | |
| SCHEMBL2009526 | 0.86 | HPGDS (0.64) | CSNK1DNPC1RAB9AJAK2JAK3 | |
| SCHEMBL851716 | 0.85 | NPC1 (0.51) | NPC1RAB9ACA12CA1CA2 | |
| SCHEMBL29914699 | 0.85 | HSD17B1 (0.56) | HSD17B1HSD17B2CA12CA1CA2 | |
| SCHEMBL21228142 | 0.85 | HSD17B1 (0.56) | HSD17B1HSD17B2CA12CA1CA2 | |
| SCHEMBL1222552 | 0.85 | NPC1 (0.62) | NPC1RAB9ATP53MAPTHPGDS | |
| SCHEMBL1749701 | 0.84 | TP53 (0.48) | NPC1RAB9ATP53MAPTHPGDS | |
| SCHEMBL2218765 | 0.82 | NPC1 (0.46) | NPC1RAB9ATP53MAPTHPGDS | |
| SCHEMBL1749621 | 0.82 | NPC1 (0.46) | NPC1RAB9ATP53MAPTHPGDS | |
| SCHEMBL3900684 | 0.82 | NPC1 (0.56) | NPC1RAB9ACA12CA1CA2 |
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-6831106-B1 | Selective activity on cell proliferation and differentiation without displaying any hypercalcaemiant nature | GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) | 2004-12-14 | — | — | US | disclosed |