Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.38 |
| ▸ | ALDH5A1 | P51649 | 1/20 | 0.38 |
| ▸ | ABAT | P80404 | 1/20 | 0.38 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.38 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.36 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.36 |
| ▸ | TUBB1 | Q9H4B7 | 4/20 | 0.36 |
| ▸ | TUBB4A | P04350 | 3/20 | 0.36 |
| ▸ | TUBB | P07437 | 3/20 | 0.36 |
| ▸ | TUBA3C | P0DPH7 | 3/20 | 0.36 |
| ▸ | TUBA1B | P68363 | 3/20 | 0.36 |
| ▸ | TUBA4A | P68366 | 3/20 | 0.36 |
| ▸ | TUBB4B | P68371 | 3/20 | 0.36 |
| ▸ | TUBB3 | Q13509 | 3/20 | 0.36 |
| ▸ | TUBB2A | Q13885 | 3/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4422311 | 0.97 | ALDH1A1 (0.42) | ALDH1A1TSHRHPGDMAPK1TDP1 | |
| SCHEMBL3679228 | 0.90 | ALDH1A1 (0.35) | ALDH1A1TSHRHPGDMAPK1TDP1 | |
| SCHEMBL1620299 | 0.87 | ALDH1A1 (0.44) | ALDH1A1TSHRHPGDMAPK1TDP1 | |
| SCHEMBL6791906 | 0.83 | ALDH1A1 (0.40) | ALDH1A1TSHRHPGDMAPK1TDP1 | |
| SCHEMBL6061801 | 0.81 | ALDH1A1 (0.40) | ALDH1A1TSHRHPGDMAPK1TDP1 | |
| SCHEMBL30876424 | 0.81 | ALDH1A1 (0.52) | ALDH1A1TSHRHPGDMAPK1TDP1 | |
| SCHEMBL3686242 | 0.81 | ALDH1A1 (0.52) | ALDH1A1TSHRHPGDMAPK1TDP1 | |
| SCHEMBL498989 | 0.81 | ALDH1A1 (0.64) | ALDH1A1TSHRHPGDTDP1TRIM24 | |
| SCHEMBL30504088 | 0.81 | ALDH1A1 (0.64) | ALDH1A1TSHRHPGDTDP1TRIM24 | |
| SCHEMBL22428 | 0.81 | ALDH1A1 (0.64) | ALDH1A1TSHRHPGDTDP1TRIM24 |
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 4 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 | claimed |
| US-5721362-A | Process for producing ecteinascidin compounds | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 1998-02-24 | — | — | US | claimed |
| EP-0931083-B1 | PROCESS FOR PRODUCING ECTEINASCIDIN COMPOUNDS | HARVARD COLLEGE (US) | 2003-02-19 | — | — | EP | disclosed |
| US-5721362-A | Process for producing ecteinascidin compounds | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 1998-02-24 | — | — | US | disclosed |