Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NISCH | Q9Y2I1 | 6/20 | 0.40 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.40 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 3/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.36 |
| ▸ | RELA | Q04206 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL2282129 | 0.70 | NISCH (0.44) | NISCHCHRNB4CHRNA3ALDH1A1GAA | |
| SCHEMBL11316228 | 0.70 | NISCH (0.36) | NISCHCHRNB4CHRNA3ALDH1A1GAA | |
| SCHEMBL21151453 | 0.66 | ALDH1A1 (0.53) | ALDH1A1RAB9ANPC1MAPK1NFKB1 | |
| SCHEMBL895819 | 0.63 | CHRNB4 (0.67) | NISCHCHRNB4CHRNA3ALDH1A1GAA | |
| SCHEMBL11531367 | 0.60 | NOS3 (0.33) | SIGMAR1 | |
| SCHEMBL9342945 | 0.60 | NISCH (0.33) | NISCHCHRNB4CHRNA3GAATSHR | |
| Biphenyl SCHEMBL4002609 | 0.60 | ALDH1A1 (1.00) | ALDH1A1RAB9ANPC1MAPK1NFKB1 | |
| Biphenyl SCHEMBL164 | 0.60 | ALDH1A1 (1.00) | ALDH1A1RAB9ANPC1MAPK1NFKB1 | |
| Biphenyl SCHEMBL1358618 | 0.60 | ALDH1A1 (1.00) | ALDH1A1RAB9ANPC1MAPK1NFKB1 | |
| Biphenyl SCHEMBL2548048 | 0.60 | ALDH1A1 (1.00) | ALDH1A1RAB9ANPC1MAPK1NFKB1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0639182-A1 | QUINOLINE DERIVATIVES | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1995-02-22 | — | — | EP | claimed |
| WO-1992018483-A1 | QUINOLINE DERIVATIVES | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1992-10-29 | — | — | WO | claimed |
| EP-0639182-A1 | QUINOLINE DERIVATIVES | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1995-02-22 | — | — | EP | disclosed |
| WO-1992018483-A1 | QUINOLINE DERIVATIVES | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1992-10-29 | — | — | WO | disclosed |