Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.51 |
| ▸ | RAB9A | P51151 | 3/20 | 0.51 |
| ▸ | NPC1 | O15118 | 2/20 | 0.51 |
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.51 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.51 |
| ▸ | RELA | Q04206 | 1/20 | 0.51 |
| ▸ | HTT | P42858 | 4/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 7/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | NPY1R | P25929 | 1/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | NPY2R | P49146 | 1/20 | 0.42 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.41 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6868487 | 1.00 | SMN1; SMN2 (0.51) | SMN1; SMN2RAB9ANPC1TP53NFKB1 | |
| SCHEMBL6874686 | 0.97 | RAB9A (0.53) | SMN1; SMN2RAB9ANPC1TP53NFKB1 | |
| SCHEMBL6874693 | 0.97 | RAB9A (0.53) | SMN1; SMN2RAB9ANPC1TP53NFKB1 | |
| SCHEMBL6873478 | 0.93 | SMN1; SMN2 (0.51) | SMN1; SMN2RAB9ANPC1TP53NFKB1 | |
| SCHEMBL6873468 | 0.93 | SMN1; SMN2 (0.51) | SMN1; SMN2RAB9ANPC1TP53NFKB1 | |
| SCHEMBL6874434 | 0.88 | EGFR (0.47) | SMN1; SMN2RAB9ANPC1HTTPOLB | |
| SCHEMBL6874447 | 0.88 | EGFR (0.47) | SMN1; SMN2RAB9ANPC1HTTPOLB | |
| SCHEMBL4211418 | 0.85 | MCHR1 (0.55) | SMN1; SMN2RAB9ANPC1TP53NFKB1 | |
| SCHEMBL4211417 | 0.85 | MCHR1 (0.55) | SMN1; SMN2RAB9ANPC1TP53NFKB1 | |
| SCHEMBL6874938 | 0.84 | EGFR (0.54) | SMN1; SMN2RAB9ANPC1NFKB1NFKB2 |
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-1464335-A2 | Quinoline, tetrahydroquinoline and pyrimidine derivatives as mch antagonist | Taisho Pharmaceutical Co. Ltd. (JP) | 2004-10-06 | — | — | EP | disclosed |