Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.62 |
| ▸ | POLB | P06746 | 4/20 | 0.62 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.62 |
| ▸ | HPGD | P15428 | 3/20 | 0.62 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.51 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.51 |
| ▸ | HTT | P42858 | 2/20 | 0.51 |
| ▸ | CASP1 | P29466 | 1/20 | 0.51 |
| ▸ | CASP7 | P55210 | 1/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.51 |
| ▸ | BRD4 | O60885 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 5/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.50 |
| ▸ | PKM | P14618 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.50 |
| ▸ | KLK7 | P49862 | 1/20 | 0.49 |
| ▸ | PTPRB | P23467 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28552747 | 0.89 | MEN1 (0.55) | ALDH1A1POLBKDM4EHPGDHTT | |
| Hydrochloric Acid SCHEMBL9080391 | 0.87 | ALDH1A1 (0.59) | ALDH1A1POLBKDM4EHPGDCDK5 | |
| SCHEMBL11694697 | 0.86 | MAPT (0.60) | ALDH1A1POLBKDM4EHPGDCDK5 | |
| SCHEMBL11687814 | 0.84 | POLB (0.55) | ALDH1A1POLBKDM4EHPGDCDK5 | |
| SCHEMBL11687308 | 0.83 | ALDH1A1 (0.53) | ALDH1A1POLBKDM4EHPGDCDK5 | |
| SCHEMBL29774545 | 0.82 | ALDH1A1 (0.50) | ALDH1A1POLBKDM4EHPGDCDK5 | |
| SCHEMBL9078891 | 0.82 | CDK5 (0.67) | ALDH1A1POLBKDM4EHPGDCDK5 | |
| Butane SCHEMBL11876142 | 0.80 | MEN1 (0.65) | ALDH1A1POLBKDM4EHPGDHTT | |
| SCHEMBL28495677 | 0.78 | MEN1 (0.60) | ALDH1A1POLBKDM4EHPGDHTT | |
| SCHEMBL25841408 | 0.78 | CDK5 (0.58) | ALDH1A1POLBKDM4EHPGDCDK5 |
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-1992005153-A1 | ANTIPROLIFERATIVE SUBSTITUTED NAPHTHALENE COMPOUNDS | AGOURON PHARMACEUTICALS, INC. (US) | 1992-04-02 | — | — | WO | disclosed |