Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | ABCG2 | Q9UNQ0 | 5/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | HPRT1 | P00492 | 2/20 | 0.44 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.43 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.43 |
| ▸ | ERN1 | O75460 | 1/20 | 0.41 |
| ▸ | ABCC1 | P33527 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL16082559 | 0.78 | ALDH1A1 (0.54) | ALDH1A1KDM4EMAPK1SMN1; SMN2MAPT | |
| SCHEMBL4599843 | 0.78 | HPRT1 (0.42) | ALDH1A1KDM4EMAPK1MAPTABCG2 | |
| SCHEMBL1824124 | 0.77 | TSHR (0.56) | ALDH1A1KDM4EMAPK1SMN1; SMN2MAPT | |
| SCHEMBL16067921 | 0.77 | ALDH1A1 (0.52) | ALDH1A1KDM4EMAPK1SMN1; SMN2MAPT | |
| SCHEMBL278576 | 0.77 | MAPT (0.67) | ALDH1A1KDM4EMAPK1SMN1; SMN2MAPT | |
| SCHEMBL30380487 | 0.77 | MAPT (0.67) | ALDH1A1KDM4EMAPK1SMN1; SMN2MAPT | |
| SCHEMBL16067924 | 0.76 | NPC1 (0.41) | ALDH1A1KDM4EMAPK1SMN1; SMN2MAPT | |
| Ammonia Solution, Strong SCHEMBL11476305 | 0.75 | MAPT (0.64) | ALDH1A1KDM4EMAPK1SMN1; SMN2MAPT | |
| SCHEMBL1402503 | 0.75 | ALDH1A1 (0.50) | ALDH1A1KDM4EMAPK1SMN1; SMN2MAPT | |
| SCHEMBL5249090 | 0.75 | ALDH1A1 (0.50) | ALDH1A1KDM4EMAPK1SMN1; SMN2MAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-105593217-B | Terazololine-one compound and application thereof | 住友化学株式会社 | 2018-05-25 | — | — | CN | disclosed |