Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | ERN1 | O75460 | 12/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | NQO2 | P16083 | 2/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9908795 | 0.82 | CYP3A4 (0.40) | LMNAHPGDALDH1A1MAPT | |
| SCHEMBL784919 | 0.77 | CYP3A4 (0.36) | LMNAALDH1A1MAPTNQO2CYP19A1 | |
| SCHEMBL2232816 | 0.75 | ALDH1A1 (0.45) | LMNAHPGDERN1ALDH1A1MAPT | |
| SCHEMBL12553097 | 0.74 | LMNA (0.46) | LMNAHPGDERN1ALDH1A1MAPT | |
| SCHEMBL14747985 | 0.73 | KDM4E (0.46) | LMNAHPGDALDH1A1HSD17B10TDP1 | |
| SCHEMBL10430741 | 0.72 | ERN1 (0.44) | LMNAHPGDERN1ALDH1A1MAPT | |
| SCHEMBL14070022 | 0.71 | LMNA (0.64) | LMNAHPGDERN1ALDH1A1MAPT | |
| SCHEMBL30705750 | 0.71 | ERN1 (0.65) | ERN1 | |
| SCHEMBL14284000 | 0.71 | CYP3A4 (0.38) | ALDH1A1NQO2CYP19A1 | |
| SCHEMBL30634677 | 0.71 | LMNA (0.55) | LMNAHPGDERN1ALDH1A1MAPT |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0931083-B1 | PROCESS FOR PRODUCING ECTEINASCIDIN COMPOUNDS | HARVARD COLLEGE (US) | 2003-02-19 | — | — | EP | disclosed |
| EP-0931083-A4 | PROCESS FOR PRODUCING ECTEINASCIDIN COMPOUNDS | HARVARD COLLEGE (US) | 2000-05-24 | — | — | EP | disclosed |
| EP-0931083-A1 | PROCESS FOR PRODUCING ECTEINASCIDIN COMPOUNDS | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 1999-07-28 | — | — | EP | disclosed |
| WO-1998012198-A1 | PROCESS FOR PRODUCING ECTEINASCIDIN COMPOUNDS | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 1998-03-26 | — | — | WO | disclosed |
| US-5721362-A | Process for producing ecteinascidin compounds | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 1998-02-24 | — | — | US | disclosed |