Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 4/20 | 0.39 |
| ▸ | S1PR3 | Q99500 | 4/20 | 0.39 |
| ▸ | AAK1 | Q2M2I8 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 5/20 | 0.39 |
| ▸ | NPC1 | O15118 | 4/20 | 0.39 |
| ▸ | HPGD | P15428 | 3/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.39 |
| ▸ | NFKB2 | Q00653 | 3/20 | 0.39 |
| ▸ | RELA | Q04206 | 3/20 | 0.39 |
| ▸ | STAT1 | P42224 | 1/20 | 0.39 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | IKBKB | O14920 | 1/20 | 0.37 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.36 |
| ▸ | LTA4H | P09960 | 1/20 | 0.36 |
| ▸ | XDH | P47989 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | DRD3 | P35462 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7735956 | 0.85 | S1PR1 (0.39) | S1PR1S1PR3RAB9ANPC1HPGD | |
| SCHEMBL7735961 | 0.84 | LOXL2 (0.51) | RAB9ANPC1HPGDNFKB1NFKB2 | |
| SCHEMBL28201482 | 0.72 | KDM4E (0.67) | S1PR1S1PR3RAB9ANPC1HPGD | |
| SCHEMBL7733803 | 0.72 | HPGD (0.35) | S1PR1S1PR3RAB9ANPC1HPGD | |
| SCHEMBL24477047 | 0.69 | RAB9A (0.47) | S1PR1S1PR3RAB9ANPC1HPGD | |
| SCHEMBL7731411 | 0.68 | HPGD (0.51) | RAB9ANPC1HPGDNFKB1NFKB2 | |
| SCHEMBL7733999 | 0.66 | IDO1 (0.43) | RAB9ANPC1HPGDPKML3MBTL1 | |
| SCHEMBL4884951 | 0.64 | LOXL2 (0.55) | RAB9ANPC1HPGDNFKB1NFKB2 | |
| SCHEMBL13239665 | 0.64 | KDM4E (0.43) | RAB9ANPC1HPGDNFKB1NFKB2 | |
| SCHEMBL22455603 | 0.64 | HDAC6 (0.43) | RAB9ANPC1HPGDNFKB1NFKB2 |
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-6436980-B1 | TRANSPORT PROTEIN SUPPRESSORS; MICROBIOCIDES | ESSENTIAL THERAPEUTICS, INC. | 2002-08-20 | — | — | US | disclosed |
| US-6204279-B1 | SECONDARY AMIDE CONTAINING BENZOXAZOLE DERIVATIVES | MICROCIDE PHARMACEUTICALS, INC. | 2001-03-20 | — | — | US | disclosed |