Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | RAB9A | P51151 | 7/20 | 0.44 |
| ▸ | NPC1 | O15118 | 6/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | PDE5A | O76074 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL11282512 | 0.82 | KDM4E (0.49) | ALDH1A1RAB9ANPC1KDM4ESMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL11302191 | 0.79 | ALDH1A1 (0.47) | ALDH1A1KDM4EHPGDSMN1; SMN2MAPT | |
| SCHEMBL2650300 | 0.74 | ALDH1A1 (0.44) | ALDH1A1RAB9ANPC1KDM4EHPGD | |
| SCHEMBL2649504 | 0.74 | ALDH1A1 (0.45) | ALDH1A1RAB9ANPC1KDM4EHPGD | |
| SCHEMBL15503833 | 0.69 | ALDH1A1 (0.54) | ALDH1A1RAB9ANPC1SMN1; SMN2MAPT | |
| SCHEMBL240983 | 0.68 | SIGMAR1 (0.49) | ALDH1A1KDM4EMAPTMEN1KMT2A | |
| Hydrochloric Acid SCHEMBL11349275 | 0.67 | RAB9A (0.46) | ALDH1A1RAB9ANPC1KDM4EHPGD | |
| SCHEMBL11374065 | 0.67 | MAPT (0.44) | ALDH1A1RAB9ANPC1KDM4EMAPT | |
| SCHEMBL11299047 | 0.66 | ALDH1A1 (0.53) | ALDH1A1KDM4ESMN1; SMN2TDP1HTT | |
| SCHEMBL10593084 | 0.65 | TNK2 (0.46) | ALDH1A1KDM4EMAPTMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0005745-B1 | PYRAZOLO (3,4-C) AND THIAZOLO (5,4-C) ISOQUINOLINES, METHODS FOR PREPARING THEM, THESE COMPOUNDS FOR USE AS ANTIINFLAMMATORY, CNS-DEPRESSANT AND ANTI-ANXIETY AGENTS AND PHARMACEUTICAL COMPOSITIONS THEREOF | GRUPPO LEPETIT S.P.A. (IT) | 1982-07-14 | — | — | EP | disclosed |
| US-4232017-A | CNS DEPRESSANTS; TRANQUILIZERS | GRUPPO LEPETIT S.P.A. (IT) | 1980-11-04 | — | — | US | disclosed |