Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 6/20 | 0.45 |
| ▸ | F10 | P00742 | 3/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | MGLL | Q99685 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7069359 | 0.96 | THRB (0.48) | THRBSMN1; SMN2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL7074664 | 0.91 | THRB (0.53) | THRBSMN1; SMN2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL7071746 | 0.86 | MEN1 (0.54) | SMN1; SMN2CYP2D6CYP2C9CYP2C19LMNA | |
| SCHEMBL7070562 | 0.86 | F10 (0.57) | F10ATM | |
| SCHEMBL7069907 | 0.85 | VCAM1 (0.52) | SMN1; SMN2LMNAATMMGLLMEN1 | |
| SCHEMBL8080659 | 0.85 | LMNA (0.55) | SMN1; SMN2LMNAHTTMEN1ALDH1A1 | |
| SCHEMBL7071596 | 0.85 | LMNA (0.54) | THRBSMN1; SMN2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL7074109 | 0.85 | ALDH1A1 (0.48) | THRBSMN1; SMN2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL8073643 | 0.84 | ALDH1A1 (0.56) | SMN1; SMN2CYP2D6CYP2C9CYP2C19LMNA | |
| SCHEMBL7074222 | 0.84 | LMNA (0.62) | THRBSMN1; SMN2CYP2D6CYP2C9CYP2C19 |
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-1025086-A1 | BENZAMIDINE DERIVATIVES AS FACTOR XA INHIBITORS | MERCK PATENT GmbH (DE) | 2000-08-09 | — | — | EP | disclosed |
| WO-1999016751-A1 | BENZAMIDINE DERIVATIVES AS FACTOR XA INHIBITORS | MERCK PATENT GMBH (DE) | 1999-04-08 | — | — | WO | disclosed |