Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | POLB | P06746 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.36 |
| ▸ | NPC1 | O15118 | 4/20 | 0.36 |
| ▸ | RAB9A | P51151 | 4/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | GAA | P10253 | 3/20 | 0.36 |
| ▸ | HPGD | P15428 | 3/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | CASP7 | P55210 | 1/20 | 0.36 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.36 |
| ▸ | RELA | Q04206 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL19102522 | 0.82 | ALDH1A1 (0.41) | ALDH1A1CA12CA2CA9 | |
| SCHEMBL15966239 | 0.78 | ALDH1A1 (0.41) | MAPTPOLBALDH1A1KDM4EGAA | |
| SCHEMBL10174084 | 0.74 | ALDH1A1 (0.41) | ALDH1A1NPC1RAB9AGAAHPGD | |
| SCHEMBL13816219 | 0.73 | ALDH1A1 (0.38) | MAPTPOLBALDH1A1KDM4ENPC1 | |
| SCHEMBL21511283 | 0.73 | CYP2C9 (0.39) | MAPTPOLBALDH1A1KDM4ECYP2D6 | |
| SCHEMBL29435118 | 0.72 | KMT2A (0.48) | MAPTPOLBALDH1A1KDM4ENPC1 | |
| SCHEMBL28267692 | 0.72 | KMT2A (0.44) | MAPTPOLBALDH1A1KDM4ENPC1 | |
| SCHEMBL15117438 | 0.72 | KMT2A (0.48) | MAPTPOLBALDH1A1KDM4ENPC1 | |
| SCHEMBL15117439 | 0.72 | KMT2A (0.48) | MAPTPOLBALDH1A1KDM4ENPC1 | |
| SCHEMBL177890 | 0.72 | ALDH1A1 (0.48) | MAPTALDH1A1KDM4ENPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019103952-A1 | SULFONE PYRIDINE ALKYL AMIDE-SUBSTITUTED HETEROARYL COMPOUNDS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2019-05-31 | — | — | WO | disclosed |