Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | PTGS2 | P35354 | 8/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 4/20 | 0.43 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.43 |
| ▸ | TUBB | P07437 | 1/20 | 0.43 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.43 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.43 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.43 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.43 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.43 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.43 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.43 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.43 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.43 |
| ▸ | TUBA1C | Q9BQE3 | 1/20 | 0.43 |
| ▸ | TUBB6 | Q9BUF5 | 1/20 | 0.43 |
| ▸ | TUBB2B | Q9BVA1 | 1/20 | 0.43 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL5097191 | 0.86 | KLKB1 (0.45) | MAPTPTGS2PTGS1TUBB4ATUBB | |
| SCHEMBL12632739 | 0.84 | MYC (0.52) | MAPTKDM4EALDH1A1POLBTHRB | |
| SCHEMBL2852699 | 0.84 | LMNA (0.48) | MAPTCYP1A2CYP2C9CYP2C19KDM4E | |
| SCHEMBL5107199 | 0.82 | KDM4E (0.45) | MAPTPTGS2PTGS1KDM4EALDH1A1 | |
| SCHEMBL22143066 | 0.79 | MAPT (0.44) | MAPTKDM4EALDH1A1POLBTHRB | |
| SCHEMBL31255120 | 0.77 | CYP1A2 (0.50) | PTGS2CYP1A2CYP2C9CYP2C19KDM4E | |
| SCHEMBL31255121 | 0.77 | CYP1A2 (0.50) | PTGS2CYP1A2CYP2C9CYP2C19KDM4E | |
| SCHEMBL5096940 | 0.74 | KLKB1 (0.47) | PTGS2PTGS1PTGER1 | |
| SCHEMBL7326434 | 0.74 | TP53 (0.43) | MAPTPTGS2KDM4EALDH1A1GAA | |
| SCHEMBL6172133 | 0.74 | PTGS2 (0.69) | MAPTPTGS2PTGS1CYP1A2CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0991625-A2 | INHIBITORS OF FACTOR XA WITH A NEUTRAL P1 SPECIFICITY GROUP | THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) | 2000-04-12 | — | — | EP | disclosed |
| WO-1998057937-A2 | INHIBITORS OF FACTOR XA WITH A NEUTRAL P1 SPECIFICITY GROUP | THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) | 1998-12-23 | — | — | WO | disclosed |