Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRCP | P42785 | 1/20 | 0.68 |
| ▸ | TSHR | P16473 | 2/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.59 |
| ▸ | MAPT | P10636 | 1/20 | 0.59 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.59 |
| ▸ | RAB9A | P51151 | 1/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.57 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
| ▸ | LMNA | P02545 | 1/20 | 0.55 |
| ▸ | CTRB1 | P17538 | 1/20 | 0.54 |
| ▸ | GFER | P55789 | 1/20 | 0.54 |
| ▸ | FKBP1A | P62942 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.53 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.53 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL31420576 | 0.88 | PRCP (0.58) | PRCPTSHRCYP3A4MAPTCYP2C9 | |
| SCHEMBL11433568 | 0.87 | PRCP (0.87) | PRCPTSHRCYP3A4MAPTCYP2C9 | |
| SCHEMBL3961276 | 0.86 | CTRB1 (0.53) | PRCPTSHRCYP3A4MAPTCYP2C9 | |
| SCHEMBL11331803 | 0.86 | PRCP (0.89) | PRCPTSHRCYP3A4MAPTCYP2C9 | |
| SCHEMBL11841484 | 0.86 | PRCP (0.89) | PRCPTSHRCYP3A4MAPTCYP2C9 | |
| SCHEMBL7273208 | 0.86 | PRCP (0.82) | PRCPTSHRCYP3A4MAPTCYP2C9 | |
| SCHEMBL10763737 | 0.86 | PRCP (0.82) | PRCPTSHRCYP3A4MAPTCYP2C9 | |
| SCHEMBL7337615 | 0.85 | ITGB3 (0.58) | PRCPMAPTITGB3ITGA2B | |
| SCHEMBL9277793 | 0.84 | PRCP (0.75) | PRCPTSHRCYP3A4MAPTCYP2C9 | |
| SCHEMBL9277796 | 0.84 | PRCP (0.75) | PRCPTSHRCYP3A4MAPTCYP2C9 |
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-5583146-A | Heterocyclic thrombin inhibitors | BRISTOL-MYERS SQUIBB COMPANY (US) | 1996-12-10 | — | — | US | disclosed |
| EP-0601459-A2 | Sulfonamido heterocyclic thrombin inhibitors | BRISTOL-MYERS SQUIBB COMPANY (US) | 1994-06-15 | — | — | EP | disclosed |
| US-4346078-A | Novel anticoagulant agmatine derivatives and process for the preparation thereof | RICHTER GEDEON VEGYESZETI GYAR RT. (HU) | 1982-08-24 | — | — | US | disclosed |