Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTRB1 | P17538 | 1/20 | 0.51 |
| ▸ | PIN1 | Q13526 | 2/20 | 0.49 |
| ▸ | CTSL | P07711 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 3/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.46 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.46 |
| ▸ | RPS6KA4 | O75676 | 1/20 | 0.46 |
| ▸ | PRKACA | P17612 | 1/20 | 0.46 |
| ▸ | GSK3A | P49840 | 1/20 | 0.46 |
| ▸ | GSK3B | P49841 | 1/20 | 0.46 |
| ▸ | IRAK1 | P51617 | 1/20 | 0.46 |
| ▸ | PRKX | P51817 | 1/20 | 0.46 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.46 |
| ▸ | PRKG1 | Q13976 | 1/20 | 0.46 |
| ▸ | PKN2 | Q16513 | 1/20 | 0.46 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.46 |
| ▸ | SGK2 | Q9HBY8 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL9459542 | 0.85 | MAPT (0.45) | RAB9ANPC1MAPK1CYP3A4CYP1A2 | |
| SCHEMBL8837469 | 0.80 | FCER2 (0.50) | CTRB1RAB9ANPC1MAPK1CYP3A4 | |
| SCHEMBL9588793 | 0.79 | CYP3A4 (0.46) | RAB9ANPC1MAPK1CYP3A4CYP1A2 | |
| SCHEMBL7450894 | 0.78 | MME (0.52) | RAB9ANPC1MAPK1CYP3A4CYP1A2 | |
| SCHEMBL9587602 | 0.77 | MME (0.48) | CTRB1RAB9ANPC1MAPK1CYP3A4 | |
| SCHEMBL9068533 | 0.77 | MME (0.62) | MAPK1CYP3A4MME | |
| SCHEMBL18576675 | 0.76 | CTRB1 (0.65) | CTRB1CTSLCYP3A4CYP1A2CYP2C9 | |
| SCHEMBL9588619 | 0.76 | CYP3A4 (0.54) | CTRB1RAB9ANPC1MAPK1CYP3A4 | |
| SCHEMBL9587952 | 0.76 | MME (0.47) | CTRB1RAB9ANPC1MAPK1CYP3A4 | |
| SCHEMBL9459027 | 0.75 | SLC7A5 (0.42) | RAB9AALDH1A1SLC7A5MME |
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 |
|---|---|---|---|---|---|---|---|
| JP-4112865-A | — | — | None | — | — | JP | disclosed |
| JP-H04112865-A | SUBSTITUTED AMIDE DERIVATIVE | DAINIPPON PHARMACEUT CO LTD | 1992-04-14 | — | — | JP | disclosed |