Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 10/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.32 |
| ▸ | HDAC4 | P56524 | 3/20 | 0.32 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.32 |
| ▸ | HDAC10 | Q969S8 | 3/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.32 |
| ▸ | HDAC9 | Q9UKV0 | 3/20 | 0.32 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.32 |
| ▸ | IDH1 | O75874 | 2/20 | 0.31 |
| ▸ | ITGB3 | P05106 | 3/20 | 0.31 |
| ▸ | ITGAV | P06756 | 3/20 | 0.31 |
| ▸ | ITGB5 | P18084 | 1/20 | 0.31 |
| ▸ | HDAC7 | Q8WUI4 | 5/20 | 0.31 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.31 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.30 |
| ▸ | RIPK1 | Q13546 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL24521894 | 1.00 | HDAC1 (0.33) | HDAC1POLBHDAC3HDAC4HDAC2 | |
| SCHEMBL20140212 | 0.84 | IDH1 (0.33) | IDH1ITGB3ITGAVITGB5 | |
| SCHEMBL20141062 | 0.77 | FNTA (0.33) | POLBIDH1ITGAV | |
| SCHEMBL20140041 | 0.77 | ITGB3 (0.40) | ITGB3ITGAVITGB5 | |
| SCHEMBL20140049 | 0.77 | ITGB3 (0.40) | ITGB3ITGAVITGB5 | |
| SCHEMBL20140045 | 0.77 | ITGB3 (0.40) | ITGB3ITGAVITGB5 | |
| SCHEMBL20141294 | 0.77 | ITGB3 (0.40) | ITGB3ITGAVITGB5 | |
| SCHEMBL20153509 | 0.77 | ITGB3 (0.40) | ITGB3ITGAVITGB5 | |
| SCHEMBL21294622 | 0.77 | ITGB3 (0.40) | ITGB3ITGAVITGB5 | |
| SCHEMBL29797302 | 0.77 | ITGB3 (0.40) | ITGB3ITGAVITGB5 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3538525-B1 | 3-SUBSTITUTED PROPIONIC ACIDS AS ALPHA V INTEGRIN INHIBITORS | BRISTOL MYERS SQUIBB CO (US) | 2022-06-22 | — | — | EP | disclosed |