Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HIF1A | Q16665 | 2/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | MIF | P14174 | 1/20 | 0.42 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | KCNN4 | O15554 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA5A | P35218 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 2/20 | 0.39 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28110962 | 0.81 | HIF1A (0.39) | HIF1ACYP2C19PTPN1SMN1; SMN2CYP1A2 | |
| SCHEMBL637562 | 0.80 | HIF1A (0.59) | HIF1ACYP2C19MIFSMN1; SMN2CYP1A2 | |
| SCHEMBL17047062 | 0.80 | HIF1A (0.50) | HIF1ACYP2C19MIFPTPN1SMN1; SMN2 | |
| SCHEMBL17047065 | 0.80 | HIF1A (0.50) | HIF1ACYP2C19MIFPTPN1SMN1; SMN2 | |
| SCHEMBL28483320 | 0.78 | CYP2C19 (0.57) | HIF1ACYP2C19MIFPTPN1SMN1; SMN2 | |
| SCHEMBL6491100 | 0.78 | CYP2C19 (0.57) | HIF1ACYP2C19MIFPTPN1SMN1; SMN2 | |
| SCHEMBL1081533 | 0.78 | HIF1A (0.57) | HIF1ACYP2C19MIFSMN1; SMN2CYP1A2 | |
| SCHEMBL503257 | 0.78 | MIF (0.65) | HIF1ACYP2C19MIFCYP1A2KCNN4 | |
| SCHEMBL20546665 | 0.76 | MIF (0.63) | HIF1ACYP2C19MIFCYP1A2KCNN4 | |
| SCHEMBL2300536 | 0.75 | CYP2C19 (0.64) | HIF1ACYP2C19SMN1; SMN2CYP1A2CYP2D6 |
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-1196436-A2 | PEPTIDE BORONIC ACID INHIBITORS OF HEPATITIS C VIRUS PROTEASE | Bristol-Myers Squibb Pharma Company (US) | 2002-04-17 | — | — | EP | disclosed |
| WO-2001002424-A2 | PEPTIDE BORONIC ACID INHIBITORS OF HEPATITIS C VIRUS PROTEASE | DU PONT PHARMACEUTICALS COMPANY (US) | 2001-01-11 | — | — | WO | disclosed |