Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | ATM | Q13315 | 1/20 | 0.30 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.30 |
| ▸ | SLC7A11 | Q9UPY5 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Dl-Dithiothreitol SCHEMBL28874716 | 1.00 | LMNA (0.44) | LMNANR1I2ALDH1A1CYP1A2HTT | |
| Dl-Dithiothreitol SCHEMBL78921 | 1.00 | — | — | |
| Dl-Dithiothreitol SCHEMBL14496668 | 1.00 | — | — | |
| Dl-Dithiothreitol SCHEMBL87345 | 1.00 | — | — | |
| Dl-Dithiothreitol SCHEMBL10601 | 1.00 | — | — | |
| Dl-Dithiothreitol SCHEMBL17370231 | 1.00 | — | — | |
| Dithiothreitol SCHEMBL538995 | 1.00 | — | — | |
| Dl-Dithiothreitol SCHEMBL21114401 | 1.00 | LMNA (0.44) | LMNANR1I2ALDH1A1CYP1A2HTT | |
| Dl-Dithiothreitol SCHEMBL21114400 | 1.00 | LMNA (0.44) | LMNANR1I2ALDH1A1CYP1A2HTT | |
| Dl-Dithiothreitol SCHEMBL9773253 | 0.95 | — | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4422945-A | WATER TREATMENT, HYPOCHLORITE SCAVENGER | E. R. SQUIBB & SONS, INC. (US) | 1983-12-27 | — | — | US | claimed |
| EP-0938308-B1 | ANTIPARASITIC AGENTS | MERCK & CO INC (US) | 2005-07-13 | — | — | EP | disclosed |
| EP-0938308-A4 | ANTIPARASITIC AGENTS | MERCK & CO INC (US) | 2001-03-07 | — | — | EP | disclosed |
| EP-0938308-A1 | ANTIPARASITIC AGENTS | Merck & Co., Inc. (US) | 1999-09-01 | — | — | EP | disclosed |
| US-5945317-A | ISOLATED FROM FERMENTATION CULTURES OF NODULISPORUM SPECIES; FOR INSECTICIDES, NEMATOCIDES, MITICIDES | MERCK & CO., INC. (US) | 1999-08-31 | — | — | US | disclosed |
| US-5834260-A | Antiparasitic agents | MERCK & CO., INC. (US) | 1998-11-10 | — | — | US | disclosed |
| WO-1998008507-A1 | ANTIPARASITIC AGENTS | MERCK & CO., INC. (US) | 1998-03-05 | — | — | WO | disclosed |
| US-5686637-A | Antifungal agent | MERCK & CO., INC. (US) | 1997-11-11 | — | — | US | disclosed |
| WO-1996021455-A1 | ANTIFUNGAL AGENT | MERCK & CO., INC. (US) | 1996-07-18 | — | — | WO | disclosed |