Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.58 |
| ▸ | HTT | P42858 | 2/20 | 0.58 |
| ▸ | LMNA | P02545 | 2/20 | 0.58 |
| ▸ | MEN1 | O00255 | 2/20 | 0.58 |
| ▸ | MAPT | P10636 | 2/20 | 0.56 |
| ▸ | TP53 | P04637 | 3/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | PRMT1 | Q99873 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL6986976 | 0.89 | ADRB2 (0.58) | ALDH1A1KMT2ALMNAMEN1HPGD | |
| SCHEMBL7410691 | 0.87 | ALDH1A1 (0.54) | ALDH1A1KMT2AHTTLMNAMEN1 | |
| SCHEMBL6983746 | 0.86 | NR3C1 (0.47) | ALDH1A1KMT2ALMNAMEN1CYP2C9 | |
| Hydrochloric Acid SCHEMBL6985275 | 0.85 | ALDH1A1 (0.55) | ALDH1A1KMT2AHTTLMNAMEN1 | |
| SCHEMBL6976631 | 0.84 | HSD17B3 (0.46) | ALDH1A1KMT2AMEN1MAPTTP53 | |
| SCHEMBL6981640 | 0.83 | NR3C1 (0.47) | ALDH1A1KMT2AHTTLMNAMEN1 | |
| SCHEMBL6985317 | 0.83 | NR3C1 (0.58) | KMT2ALMNAMEN1MAPTTP53 | |
| SCHEMBL6985295 | 0.82 | MAPT (0.45) | ALDH1A1KMT2AHTTLMNAMEN1 | |
| SCHEMBL6985562 | 0.81 | NR3C1 (0.56) | ALDH1A1KMT2AMEN1HPGDSMN1; SMN2 | |
| SCHEMBL6977969 | 0.81 | NR3C1 (0.56) | ALDH1A1KMT2AMEN1MAPTTP53 |
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-0991624-B1 | PHENYLALKYL DERIVATIVES WITH THROMBIN-INHIBITING EFFECT | BOEHRINGER INGELHEIM PHARMA (DE) | 2003-11-19 | — | — | EP | disclosed |
| US-6300342-B1 | FOR THERAPY OR INHIBITING THROMBUS FORMATION; FOR THERAPY OF FIBRIN-DEPENDENT INFLAMMATORY CONDITION | BOEHRINGER INGELHEIM PHARM KG (DE) | 2001-10-09 | — | — | US | disclosed |