Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | CNR2 | P34972 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | BCHE | P06276 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8165807 | 1.00 | ALDH1A1 (0.51) | ALDH1A1LMNACNR2CYP1A2CYP2C9 | |
| SCHEMBL8165805 | 1.00 | ALDH1A1 (0.51) | ALDH1A1LMNACNR2CYP1A2CYP2C9 | |
| SCHEMBL2076248 | 0.86 | ALDH1A1 (0.51) | ALDH1A1LMNACNR2CYP1A2POLB | |
| SCHEMBL2076247 | 0.86 | ALDH1A1 (0.51) | ALDH1A1LMNACNR2CYP1A2POLB | |
| SCHEMBL2076249 | 0.86 | ALDH1A1 (0.51) | ALDH1A1LMNACNR2CYP1A2POLB | |
| SCHEMBL4596569 | 0.83 | ALDH1A1 (0.53) | ALDH1A1CNR2CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL6882711 | 0.81 | ALDH1A1 (0.51) | ALDH1A1CNR2CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL13536697 | 0.80 | CA2 (0.43) | ALDH1A1LMNAKMT2AGAACA12 | |
| SCHEMBL1730532 | 0.79 | STAT3 (0.46) | ALDH1A1CYP2C9CYP2C19KMT2AGAA | |
| SCHEMBL70900 | 0.79 | STAT3 (0.46) | ALDH1A1CYP2C9CYP2C19KMT2AGAA |
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 |
|---|---|---|---|---|---|---|---|
| US-6133457-A | CRYPTOPHYCIN COMPOUNDS HAVING ANTIMICROTUBULE ACTIVITY; ANTIMETABOLITES | ELI LILLY AND COMPANY (US) | 2000-10-17 | — | — | US | disclosed |
| EP-0861839-A1 | Selective epoxidation process for preparing cryptophycin compounds and intermediates | ELI LILLY AND COMPANY (US) | 1998-09-02 | — | — | EP | disclosed |