Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 3/20 | 0.54 |
| ▸ | MEN1 | O00255 | 2/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.52 |
| ▸ | ITGB3 | P05106 | 5/20 | 0.50 |
| ▸ | ITGA2B | P08514 | 5/20 | 0.50 |
| ▸ | CA12 | O43570 | 2/20 | 0.49 |
| ▸ | CA1 | P00915 | 2/20 | 0.49 |
| ▸ | CA2 | P00918 | 2/20 | 0.49 |
| ▸ | CA9 | Q16790 | 2/20 | 0.49 |
| ▸ | NAMPT | P43490 | 2/20 | 0.48 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.48 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.48 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.48 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.48 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.48 |
| ▸ | ST14 | Q9Y5Y6 | 1/20 | 0.48 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.47 |
| ▸ | ITGAV | P06756 | 1/20 | 0.47 |
| ▸ | ITGB5 | P18084 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL7303517 | 0.90 | NR1H4 (0.61) | NR1H4ITGB3ITGA2BHDAC1EPHX2 | |
| Hydrochloric Acid SCHEMBL9264373 | 0.89 | NR1H4 (0.60) | NR1H4ITGB3ITGA2BHDAC1EPHX2 | |
| SCHEMBL7297516 | 0.87 | ST14 (0.64) | NR1H4MEN1KMT2AITGB3ITGA2B | |
| SCHEMBL7303178 | 0.86 | MEN1 (0.52) | MEN1KMT2ACA12CA1CA2 | |
| SCHEMBL4109710 | 0.86 | FFAR1 (0.53) | NR1H4ITGB3ITGA2BCA1CA2 | |
| SCHEMBL7379804 | 0.85 | ITGB3 (0.55) | KMT2AITGB3ITGA2BNAMPTHDAC2 | |
| Hydrochloric Acid SCHEMBL9275424 | 0.85 | MAPT (0.51) | MEN1KMT2ACA12CA1CA2 | |
| SCHEMBL7295673 | 0.84 | MAPT (0.59) | NR1H4MEN1KMT2AITGB3ITGA2B | |
| SCHEMBL24892365 | 0.81 | ST14 (0.55) | NR1H4MEN1KMT2ACA12CA1 | |
| SCHEMBL8500653 | 0.80 | ITGB3 (0.60) | ITGB3ITGA2BHDAC2HDAC1EPHX2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0381033-B1 | Carboxylic-acid and sulphonic-acid amides | HOFFMANN LA ROCHE (CH) | 1994-03-23 | — | — | EP | claimed |
| US-5256812-A | Antitumor agents, cardiovascular disorders; having amidino or guandino groups | HOFFMANN-LA ROCHE INC. (US) | 1993-10-26 | — | — | US | claimed |
| US-5399585-A | Anitcoagulants, antiinflammatory, antitumor | HOFFMANN-LA ROCHE INC. (US) | 1995-03-21 | — | — | US | disclosed |
| US-5084466-A | Anticoagulants, antiinflammatory agents, atheriosclerosis and antitumor agents | HOFFMANN-LA ROCHE INC. (US) | 1992-01-28 | — | — | US | disclosed |