Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.52 |
| ▸ | HPGD | P15428 | 4/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 4/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | GLA | P06280 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | NCEH1 | Q6PIU2 | 1/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.46 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.45 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.45 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL8746215 | 0.91 | KDM4E (0.56) | ALDH1A1KDM4EHPGDNPSR1MEN1 | |
| SCHEMBL10559440 | 0.84 | ALDH1A1 (0.59) | ALDH1A1KDM4EHPGDNPSR1MEN1 | |
| SCHEMBL11780209 | 0.81 | ALDH1A1 (0.62) | ALDH1A1KDM4EHPGDNPSR1MEN1 | |
| SCHEMBL27718061 | 0.80 | ALDH1A1 (0.55) | ALDH1A1KDM4EHPGDNPSR1MEN1 | |
| SCHEMBL28051227 | 0.79 | GPR84 (0.43) | ALDH1A1KDM4EHPGDNPSR1MEN1 | |
| SCHEMBL1164706 | 0.79 | ALDH1A1 (0.61) | ALDH1A1KDM4EHPGDNPSR1MEN1 | |
| SCHEMBL27446391 | 0.79 | CA12 (0.43) | ALDH1A1KDM4EHPGDNPSR1MEN1 | |
| SCHEMBL580215 | 0.79 | KDM4E (0.59) | ALDH1A1KDM4EHPGDMEN1KMT2A | |
| SCHEMBL29403597 | 0.79 | ALDH1A1 (0.54) | ALDH1A1KDM4EHPGDNPSR1MEN1 | |
| SCHEMBL6761980 | 0.79 | ALDH1A1 (0.54) | ALDH1A1KDM4EHPGDNPSR1MEN1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5703089-A | ANTICANCER AGENTS | KNOLL AKTIENGESELLSCHAFT (DE) | 1997-12-30 | — | — | US | disclosed |
| EP-0757676-A1 | DIHYDRODIBENZO(DE,H)ISOQUINOLINES DERIVATIVES AND THEIR USE AS ANTI-CANCER AGENTS | KNOLL AKTIENGESELLSCHAFT (DE) | 1997-02-12 | — | — | EP | disclosed |
| WO-1995029895-A1 | DIHYDRODIBENZO(DE,H)ISOQUINOLINES DERIVATIVES AND THEIR USE AS ANTI-CANCER AGENTS | KNOLL AKTIENGESELLSCHAFT (DE) | 1995-11-09 | — | — | WO | disclosed |