Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.50 |
| ▸ | HPGD | P15428 | 5/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.50 |
| ▸ | GAA | P10253 | 2/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.50 |
| ▸ | GLA | P06280 | 1/20 | 0.50 |
| ▸ | CASP1 | P29466 | 1/20 | 0.50 |
| ▸ | CASP7 | P55210 | 1/20 | 0.50 |
| ▸ | ATM | Q13315 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 3/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA7 | P43166 | 1/20 | 0.42 |
| ▸ | XDH | P47989 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL23559707 | 0.84 | ADORA2A (0.47) | KDM4EALDH1A1HPGDMAPTGAA | |
| SCHEMBL23559591 | 0.83 | HCAR3 (0.46) | KDM4EALDH1A1HPGDMAPTGAA | |
| SCHEMBL28468125 | 0.83 | LOXL2 (0.46) | KDM4EALDH1A1HPGDMAPTGAA | |
| SCHEMBL29950049 | 0.82 | ALDH1A1 (0.43) | KDM4EALDH1A1HPGDMAPTGAA | |
| SCHEMBL7426182 | 0.82 | ALDH1A1 (0.43) | KDM4EALDH1A1HPGDMAPTGAA | |
| SCHEMBL29491274 | 0.82 | CA12 (0.46) | KDM4EALDH1A1HPGDMAPTGAA | |
| SCHEMBL25014733 | 0.82 | RET (0.44) | KDRPDGFRACDK5TYRO3 | |
| SCHEMBL24337979 | 0.82 | CA12 (0.46) | KDM4EALDH1A1HPGDMAPTGAA | |
| SCHEMBL24338456 | 0.82 | GLA (0.44) | KDM4EALDH1A1HPGDMAPTGAA | |
| SCHEMBL730909 | 0.82 | ALDH1A1 (0.45) | KDM4EALDH1A1HPGDMAPTGAA |
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-2021127166-A1 | INHIBITORS OF ENL/AF9 YEATS | THE ROCKEFELLER UNIVERSITY (US) | 2021-06-24 | — | — | WO | disclosed |