Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 5/20 | 0.42 |
| ▸ | MEN1 | O00255 | 4/20 | 0.42 |
| ▸ | PKM | P14618 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | CTSA | P10619 | 6/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.39 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.39 |
| ▸ | PTGER3 | P43115 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | CYP26A1 | O43174 | 2/20 | 0.38 |
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CRHBP | P24387 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL686868 | 0.92 | CTSA (0.42) | KMT2AMEN1PKMLMNAHTT | |
| SCHEMBL687449 | 0.90 | CTSA (0.47) | CTSA | |
| SCHEMBL688040 | 0.90 | PTGER3 (0.49) | KMT2AMEN1CTSAALDH1A1SMN1; SMN2 | |
| SCHEMBL688155 | 0.90 | PTGER3 (0.49) | KMT2AMEN1CTSAALDH1A1SMN1; SMN2 | |
| SCHEMBL687408 | 0.88 | KMT2A (0.43) | KMT2AMEN1PKMLMNAHTT | |
| SCHEMBL688008 | 0.87 | CTSA (0.41) | KMT2AMEN1LMNAHTTCTSA | |
| SCHEMBL687906 | 0.87 | PTGER3 (0.47) | CTSAALDH1A1SMN1; SMN2MAPTPTGER3 | |
| SCHEMBL687691 | 0.86 | PTGER3 (0.41) | CTSAPTGER3CYP26A1 | |
| SCHEMBL687511 | 0.86 | MEN1 (0.46) | KMT2AMEN1CTSAALDH1A1SMN1; SMN2 | |
| SCHEMBL687932 | 0.86 | EGLN1 (0.44) | KMT2AMEN1LMNAHTTCTSA |
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 |