Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.37 |
| ▸ | ELANE | P08246 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | AMPD2 | Q01433 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | CASP3 | P42574 | 1/20 | 0.34 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8972846 | 0.78 | ELANE (0.42) | LMNATSHRSMN1; SMN2CYP2C19ELANE | |
| SCHEMBL2769832 | 0.76 | CYP2D6 (0.44) | LMNATSHRSMN1; SMN2CYP2C19ELANE | |
| SCHEMBL30067766 | 0.73 | CYP2D6 (0.44) | TSHRCYP2D6MEN1KMT2AALDH1A1 | |
| SCHEMBL8973187 | 0.72 | GRM6 (0.40) | ELANEMEN1KMT2AALDH1A1 | |
| SCHEMBL30695258 | 0.72 | ELANE (0.44) | LMNATSHRSMN1; SMN2CYP2C19ELANE | |
| Hydrochloric Acid SCHEMBL4275993 | 0.70 | SIGMAR1 (0.45) | LMNATSHRSMN1; SMN2CYP2D6MEN1 | |
| SCHEMBL10384157 | 0.69 | AMPD2 (0.46) | ELANEAMPD2 | |
| Hydrochloric Acid SCHEMBL10383420 | 0.68 | AMPD2 (0.45) | ELANEAMPD2 | |
| SCHEMBL8872867 | 0.66 | ALDH1A1 (0.43) | TSHRCYP2C19CYP2D6MEN1KMT2A | |
| SCHEMBL24998568 | 0.64 | CYP2D6 (0.46) | TSHRCYP2D6ALDH1A1 |
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-5861393-A | THROMBIN INHIBITORS; VASCULAR, CARDIOVASCULAR, NERVOUS SYSTEM AND BRAIN DISORDERS; ANTIISCHEMIC AND ANTIINFLAMMATORY AGENTS; RESTENOSIS | PFIZER INC. (US) | 1999-01-19 | — | — | US | disclosed |
| US-5750520-A | SELECTIVE THROMBIN INHIBITORS; WOUND HEALING AGENTS | PFIZER INC. (US) | 1998-05-12 | — | — | US | disclosed |
| EP-0728132-B1 | ANTITHROMBOTIC AMIDINOPHENYLALANINE AND AMIDINOPYRIDYLALANINE DERIVATIVES | PFIZER LTD (GB) | 1997-07-16 | — | — | EP | disclosed |