Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | SLC22A12 | Q96S37 | 2/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1797703 | 0.81 | KEAP1 (0.49) | TSHRALDH1A1SLC22A12PTGS1PTGS2 | |
| SCHEMBL9128897 | 0.78 | NPC1 (0.37) | TSHRNPC1CA2ALDH1A1HTT | |
| SCHEMBL12932924 | 0.73 | ALDH1A1 (0.50) | TSHRNPC1CA2ALDH1A1PTGS1 | |
| SCHEMBL14830771 | 0.72 | PSIP1 (0.59) | TSHRNPC1CA2ALDH1A1SLC22A12 | |
| SCHEMBL5849242 | 0.72 | CA2 (0.46) | NPC1CA2HTTMEN1KMT2A | |
| SCHEMBL6880631 | 0.70 | APP (0.44) | TSHRNPC1CA2ALDH1A1HTT | |
| SCHEMBL384055 | 0.70 | LMNA (0.56) | TSHRALDH1A1KMT2ALMNAPOLB | |
| SCHEMBL3831681 | 0.69 | CA2 (0.40) | CA2KMT2A | |
| SCHEMBL20290538 | 0.69 | KMT2A (0.55) | TSHRCA2ALDH1A1SLC22A12MEN1 | |
| SCHEMBL3066546 | 0.69 | SLC22A12 (0.43) | CA2ALDH1A1HTTSLC22A12PTGS1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6399627-B1 | ANTICOAGULANTS; PROTHROMINASE, SERINE PROTEASE INHIBITOR; ACRYLAMIDE DERIVATIVES | COR THERAPEUTICS, INC. | 2002-06-04 | — | — | US | disclosed |
| EP-1159264-A2 | INHIBITORS OF FACTOR Xa | COR THERAPEUTICS, INC. (US) | 2001-12-05 | — | — | EP | disclosed |
| WO-2000047554-A2 | INHIBITORS OF FACTOR Xa | COR THERAPEUTICS INC. (US) | 2000-08-17 | — | — | WO | disclosed |