Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.53 |
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
| ▸ | ACHE | P22303 | 1/20 | 0.46 |
| ▸ | HTR1A | P08908 | 2/20 | 0.40 |
| ▸ | HTR2C | P28335 | 2/20 | 0.40 |
| ▸ | GSTP1 | P09211 | 5/20 | 0.37 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.35 |
| ▸ | FEN1 | P39748 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL19482556 | 0.82 | MAPT (0.48) | SMN1; SMN2MAPTCYP2C9CYP2C19HSD17B10 | |
| SCHEMBL655929 | 0.79 | MAPT (0.84) | SMN1; SMN2MAPTCYP2C9CYP2C19HSD17B10 | |
| SCHEMBL4007043 | 0.79 | ACHE (0.50) | SMN1; SMN2MAPTCYP2C9CYP2C19HSD17B10 | |
| SCHEMBL19259049 | 0.79 | MAPT (0.47) | SMN1; SMN2MAPTCYP2C9CYP2C19HSD17B10 | |
| SCHEMBL234606 | 0.73 | ALDH1A1 (0.55) | SMN1; SMN2MAPTHSD17B10RAB9AHIF1A | |
| SCHEMBL15492423 | 0.72 | MAPT (0.56) | SMN1; SMN2MAPTCYP2C9CYP2C19HSD17B10 | |
| SCHEMBL26788164 | 0.72 | ACHE (0.59) | SMN1; SMN2MAPTACHENPC1RAB9A | |
| SCHEMBL13141019 | 0.70 | — | — | |
| SCHEMBL22593402 | 0.70 | — | — | |
| SCHEMBL4002722 | 0.69 | MAPT (0.65) | SMN1; SMN2MAPTCYP2C9CYP2C19HSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1904457-B1 | COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY | RIGEL PHARMACEUTICALS INC (US) | 2017-09-06 | — | — | EP | disclosed |
| US-9732073-B2 | Compositions and methods for inhibition of the JAK pathway | RIGEL PHARMACEUTICALS, INC. (US) | 2017-08-15 | — | — | US | disclosed |