Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.40 |
| ▸ | HPGD | P15428 | 4/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | CASP1 | P29466 | 3/20 | 0.40 |
| ▸ | CASP7 | P55210 | 3/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.40 |
| ▸ | GLA | P06280 | 3/20 | 0.40 |
| ▸ | GAA | P10253 | 3/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | HTR6 | P50406 | 5/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | PARP1 | P09874 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8968885 | 0.82 | PARP1 (0.42) | ALDH1A1KDM4EHPGDTP53CASP1 | |
| SCHEMBL8969078 | 0.79 | HTR6 (0.42) | ALDH1A1KDM4EHPGDTP53CASP1 | |
| SCHEMBL8968998 | 0.78 | ALDH1A1 (0.46) | ALDH1A1KDM4EHPGDHIF1ACASP1 | |
| SCHEMBL8969408 | 0.77 | ALDH1A1 (0.41) | ALDH1A1KDM4EHPGDHIF1ATP53 | |
| SCHEMBL8969191 | 0.76 | KDM4E (0.44) | ALDH1A1KDM4EHPGDHIF1ACASP1 | |
| SCHEMBL8968474 | 0.75 | NPC1 (0.44) | ALDH1A1KDM4EHPGDCASP1CASP7 | |
| SCHEMBL8969987 | 0.75 | ALDH1A1 (0.43) | ALDH1A1KDM4EHPGDHIF1ACASP1 | |
| SCHEMBL8969599 | 0.73 | KDM4E (0.44) | ALDH1A1KDM4EHPGDTP53CASP1 | |
| SCHEMBL11367838 | 0.73 | PARP1 (0.53) | ALDH1A1KDM4EHPGDTP53CASP1 | |
| SCHEMBL8969565 | 0.72 | HTR6 (0.43) | ALDH1A1KDM4EHPGDTP53CASP1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5486512-A | LEARNING ENHANCEMENT | WARNER-LAMBERT COMPANY (US) | 1996-01-23 | — | — | US | disclosed |
| WO-1993003034-A1 | QUINAZOLINE DERIVATIVES AS ACETYLCHOLINESTERASE INHIBITORS | WARNER-LAMBERT COMPANY (US) | 1993-02-18 | — | — | WO | disclosed |