Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.56 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 5/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | BLM | P54132 | 1/20 | 0.46 |
| ▸ | AGER | Q15109 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL69045 | 0.89 | ALDH1A1 (0.65) | ALDH1A1ALOX15HSD17B10HPGDMAPT | |
| SCHEMBL2372518 | 0.79 | L3MBTL1 (0.57) | ALDH1A1ALOX15MAPTKDM4ETSHR | |
| SCHEMBL9275469 | 0.78 | KDM4E (0.74) | ALDH1A1ALOX15MAPTKDM4ETSHR | |
| SCHEMBL9225575 | 0.78 | HSD17B10 (0.63) | ALDH1A1ALOX15HSD17B10HPGDMAPT | |
| SCHEMBL10900815 | 0.78 | ALDH1A1 (0.63) | ALDH1A1ALOX15HSD17B10HPGDMAPT | |
| SCHEMBL980115 | 0.78 | ALDH1A1 (0.63) | ALDH1A1ALOX15HSD17B10HPGDMAPT | |
| SCHEMBL890368 | 0.77 | KDM4E (0.55) | ALDH1A1ALOX15MAPTKDM4ETSHR | |
| Hydrochloric Acid SCHEMBL28182285 | 0.76 | KDM4E (0.53) | ALDH1A1ALOX15MAPTKDM4ETSHR | |
| SCHEMBL4069169 | 0.75 | MAPT (0.45) | ALDH1A1ALOX15MAPTKDM4ETSHR | |
| SCHEMBL1086604 | 0.74 | ALDH1A1 (0.70) | ALDH1A1MAPTKDM4ETDP1KMT2A |
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-0876369-A1 | 2- 2- (2-HYDROXYETHYL)AMINO]ETHYL]-5- 2-METHYLAMINO)ETHYL]AMINO]INDAZOLO 4,3-gh]ISOQUINOLIN-6(2H)-ONE AS ANTITUMOR AGENT | BOEHRINGER MANNHEIM ITALIA S.p.A. (IT) | 1998-11-11 | — | — | EP | claimed |
| WO-1997010245-A1 | 2-[2-[(2-HYDROXYETHYL)AMINO]ETHYL]-5-[[2-METHYLAMINO)ETHYL]AMINO]INDAZOLO[4,3-gh]ISOQUINOLIN-6(2H)-ONE AS ANTITUMOR AGENT | BOEHRINGER MANNHEIM ITALIA S.P.A. (IT) | 1997-03-20 | — | — | WO | claimed |