Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSA | P10619 | 5/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | PKM | P14618 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 4/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | CRHBP | P24387 | 1/20 | 0.39 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.39 |
| ▸ | PTGER3 | P43115 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7589554 | 0.94 | ALDH1A1 (0.51) | CTSAALDH1A1KDM4EMAPK1PKM | |
| SCHEMBL688103 | 0.94 | ALDH1A1 (0.51) | CTSAALDH1A1KDM4EMAPK1PKM | |
| SCHEMBL687232 | 0.93 | CTSA (0.46) | CTSAALDH1A1KDM4EMAPK1POLB | |
| SCHEMBL687522 | 0.92 | CTSA (0.44) | CTSAALDH1A1KDM4EMAPK1SMN1; SMN2 | |
| SCHEMBL687960 | 0.92 | ALDH1A1 (0.42) | CTSAALDH1A1KDM4EMAPK1SMN1; SMN2 | |
| SCHEMBL688172 | 0.92 | MAPT (0.41) | CTSAALDH1A1KDM4EMAPK1SMN1; SMN2 | |
| SCHEMBL688529 | 0.91 | CTSA (0.39) | CTSAMEN1KMT2APOLB | |
| SCHEMBL687681 | 0.90 | CTSA (0.42) | CTSAALDH1A1KDM4EMAPK1SMN1; SMN2 | |
| SCHEMBL688040 | 0.90 | PTGER3 (0.49) | CTSAALDH1A1KDM4EMAPK1SMN1; SMN2 | |
| SCHEMBL688155 | 0.90 | PTGER3 (0.49) | CTSAALDH1A1KDM4EMAPK1SMN1; SMN2 |
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-1203766-B1 | Carboxylic acid derivatives that inhibit the binding of integrins to their receptors | ENCYSIVE PHARMACEUTICALS INC (US) | 2012-02-29 | — | — | EP | disclosed |
| EP-1203766-A2 | Carboxylic acid derivatives that inhibit the binding of integrins to their receptors | TEXAS BIOTECHNOLOGY CORPORATION (US) | 2002-05-08 | — | — | EP | disclosed |