Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7993460 | 1.00 | MEN1 (0.43) | MEN1KMT2AL3MBTL1POLBKDM4E | |
| SCHEMBL2027827 | 0.87 | LMNA (0.40) | KMT2APOLBKDM4EUSP2HPGD | |
| SCHEMBL8015417 | 0.80 | CYP1A2 (0.34) | MEN1KMT2AKDM4EHPGDHSD17B10 | |
| SCHEMBL5731472 | 0.79 | ALDH1A1 (0.36) | MEN1KMT2AKDM4EHPGDHSD17B10 | |
| Hydrochloric Acid SCHEMBL8004631 | 0.79 | CYP1A2 (0.33) | MEN1KMT2AKDM4EHPGDHSD17B10 | |
| SCHEMBL8831892 | 0.77 | TSHR (0.46) | ALDH1A1TSHRRAB9AMAPT | |
| SCHEMBL5914830 | 0.77 | TSHR (0.46) | ALDH1A1TSHRRAB9AMAPT | |
| SCHEMBL364179 | 0.76 | ALDH1A1 (0.34) | MEN1KMT2AKDM4EHPGDHSD17B10 | |
| Hydrochloric Acid SCHEMBL364178 | 0.75 | ALDH1A1 (0.34) | MEN1KMT2AKDM4EHPGDHSD17B10 | |
| SCHEMBL19457275 | 0.73 | TSHR (0.40) | KMT2AL3MBTL1HPGDALDH1A1TSHR |
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-0810858-A4 | BORONIC ACID AND ESTER INHIBITORS OF THROMBIN | DU PONT PHARM CO (US) | 2000-11-15 | — | — | EP | disclosed |
| US-5698538-A | Boronic acid and ester inhibitors of thrombin | THE DUPONT MERCK PHARMACEUTICAL COMPANY (US) | 1997-12-16 | — | — | US | disclosed |
| EP-0810858-A2 | BORONIC ACID AND ESTER INHIBITORS OF THROMBIN | THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) | 1997-12-10 | — | — | EP | disclosed |
| US-5563127-A | USEFUL TO TREAT THROMBOSIS | THE DUPONT MERCK PHARMACEUTICAL COMPANY (US) | 1996-10-08 | — | — | US | disclosed |
| WO-1996020689-A2 | BORONIC ACID AND ESTER INHIBITORS OF THROMBIN | THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) | 1996-07-11 | — | — | WO | disclosed |