Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 4/20 | 0.50 |
| ▸ | NQO2 | P16083 | 4/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | NPC1 | O15118 | 2/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.34 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.34 |
| ▸ | RELA | Q04206 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | CTSV | O60911 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | TERT | O14746 | 1/20 | 0.32 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6677065 | 0.74 | S100B (0.42) | CYP19A1NQO2ALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL6680413 | 0.72 | CYP19A1 (0.48) | CYP19A1NQO2ALDH1A1NPC1RAB9A | |
| SCHEMBL4902672 | 0.63 | CYP19A1 (0.44) | CYP19A1NQO2ALDH1A1MAPTKDM4E | |
| SCHEMBL9488948 | 0.62 | IDO1 (0.41) | ALDH1A1RAB9AMAPTTSHRL3MBTL1 | |
| SCHEMBL7320441 | 0.62 | NFE2L2 (0.37) | CYP19A1NQO2ALDH1A1RAB9AMAPT | |
| SCHEMBL10163115 | 0.60 | TDP1 (0.50) | CYP19A1NQO2ALDH1A1NPC1RAB9A | |
| SCHEMBL27501201 | 0.60 | AURKA (0.38) | ALDH1A1NPC1RAB9AMAPTKDM4E | |
| SCHEMBL10664081 | 0.60 | L3MBTL1 (0.39) | ALDH1A1RAB9AMAPTSMN1; SMN2L3MBTL1 | |
| SCHEMBL6149994 | 0.60 | ALDH1A1 (0.43) | CYP19A1ALDH1A1MAPTTSHRKDM4E | |
| SCHEMBL10353931 | 0.59 | CYP19A1 (0.44) | CYP19A1ALDH1A1NPC1RAB9AMAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-1181341-B1 | LUMINESCENT 4-TRIFLUOROMETHYL-2-QUINOLONES WITH LONG-WAVE UV-ABSORPTION AND THE USE THEREOF | URAY GEORG (AT) | 2004-10-27 | — | — | EP | disclosed |