Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.49 |
| ▸ | NAMPT | P43490 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 3/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | DGAT2 | Q96PD7 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 4/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | SORT1 | Q99523 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | MMP2 | P08253 | 1/20 | 0.47 |
| ▸ | STAT3 | P40763 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | MMP13 | P45452 | 1/20 | 0.47 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.47 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.47 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL8373058 | 0.90 | ALDH1A1 (0.50) | SMN1; SMN2ALDH1A1POLBNPC1DGAT2 | |
| SCHEMBL7837411 | 0.88 | ALDH1A1 (0.54) | ALDH1A1NAMPTPOLBNPC1MAPT | |
| SCHEMBL15236978 | 0.87 | POLB (0.65) | SMN1; SMN2ALDH1A1NAMPTPOLBNPC1 | |
| SCHEMBL16455681 | 0.87 | ALDH1A1 (0.55) | ALDH1A1POLBNPC1DGAT2MAPT | |
| SCHEMBL4916519 | 0.81 | ALDH1A1 (0.53) | ALDH1A1POLBNPC1DGAT2MAPT | |
| SCHEMBL3752774 | 0.81 | ALDH1A1 (0.56) | ALDH1A1NAMPTPOLBNPC1DGAT2 | |
| SCHEMBL4919571 | 0.80 | ALDH1A1 (0.51) | SMN1; SMN2ALDH1A1POLBNPC1DGAT2 | |
| SCHEMBL4916272 | 0.80 | ALDH1A1 (0.56) | ALDH1A1POLBNPC1DGAT2MAPT | |
| SCHEMBL14606376 | 0.80 | TRPV1 (0.50) | ALDH1A1POLBNPC1DGAT2MAPT | |
| SCHEMBL3762834 | 0.79 | ALDH1A1 (0.60) | ALDH1A1NAMPTPOLBNPC1DGAT2 |
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-2443123-B1 | SMALL MOLECULE INHIBITORS OF SPLEEN TYROSINE KINASE (SYK) | RIGEL PHARMACEUTICALS INC (US) | 2017-04-05 | — | — | EP | disclosed |