Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 5/20 | 0.34 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | ITGAV | P06756 | 9/20 | 0.33 |
| ▸ | ITGB6 | P18564 | 5/20 | 0.33 |
| ▸ | ALB | P02768 | 2/20 | 0.32 |
| ▸ | GNPAT | O15228 | 2/20 | 0.32 |
| ▸ | PSMB11 | A5LHX3 | 1/20 | 0.30 |
| ▸ | PSMA7 | O14818 | 1/20 | 0.30 |
| ▸ | PSMB1 | P20618 | 1/20 | 0.30 |
| ▸ | PSMA1 | P25786 | 1/20 | 0.30 |
| ▸ | PSMA2 | P25787 | 1/20 | 0.30 |
| ▸ | PSMA3 | P25788 | 1/20 | 0.30 |
| ▸ | PSMA4 | P25789 | 1/20 | 0.30 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.30 |
| ▸ | PSMB9 | P28065 | 1/20 | 0.30 |
| ▸ | PSMA5 | P28066 | 1/20 | 0.30 |
| ▸ | PSMB4 | P28070 | 1/20 | 0.30 |
| ▸ | PSMB6 | P28072 | 1/20 | 0.30 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7596088 | 0.82 | ITGB3 (0.46) | ITGB3ITGA2BITGAV | |
| Hydrochloric Acid SCHEMBL7594979 | 0.80 | ITGB3 (0.48) | ITGB3ITGAV | |
| SCHEMBL7587020 | 0.69 | PKM (0.33) | — | |
| SCHEMBL16745724 | 0.61 | GNPAT (0.62) | SMN1; SMN2ALBGNPAT | |
| SCHEMBL10600983 | 0.60 | NOD1 (0.60) | SMN1; SMN2GNPAT | |
| SCHEMBL21801849 | 0.60 | NOD1 (0.60) | SMN1; SMN2GNPAT | |
| SCHEMBL10603414 | 0.60 | NOD1 (0.60) | SMN1; SMN2GNPAT | |
| SCHEMBL7719184 | 0.60 | SMN1; SMN2 (0.52) | SMN1; SMN2ALBGNPAT | |
| SCHEMBL10599643 | 0.60 | NOD1 (0.60) | SMN1; SMN2GNPAT | |
| SCHEMBL10599977 | 0.60 | NOD1 (0.60) | SMN1; SMN2GNPAT |
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-1040098-A1 | INTEGRIN RECEPTOR ANTAGONISTS | Merck & Co., Inc. (a New Jersey corp.) (US) | 2000-10-04 | — | — | EP | disclosed |
| WO-1999031061-A1 | INTEGRIN RECEPTOR ANTAGONISTS | MERCK & CO., INC. (US) | 1999-06-24 | — | — | WO | disclosed |