Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HIF1A | Q16665 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.46 |
| ▸ | PTPRB | P23467 | 2/20 | 0.46 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.46 |
| ▸ | PTPRA | P18433 | 1/20 | 0.46 |
| ▸ | CTRB1 | P17538 | 1/20 | 0.43 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.43 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | RECQL | P46063 | 2/20 | 0.42 |
| ▸ | ARG1 | P05089 | 1/20 | 0.42 |
| ▸ | ARG2 | P78540 | 1/20 | 0.42 |
| ▸ | MMP8 | P22894 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7514054 | 0.90 | SMN1; SMN2 (0.53) | HIF1ASMN1; SMN2PTPN1PTPRBPTPN2 | |
| SCHEMBL332421 | 0.85 | SMN1; SMN2 (0.49) | HIF1ASMN1; SMN2PTPN1PTPRBPTPN2 | |
| SCHEMBL180291 | 0.85 | SMN1; SMN2 (0.49) | HIF1ASMN1; SMN2PTPN1PTPRBPTPN2 | |
| SCHEMBL9211047 | 0.85 | SMN1; SMN2 (0.49) | HIF1ASMN1; SMN2PTPN1PTPRBPTPN2 | |
| SCHEMBL6321269 | 0.85 | SMN1; SMN2 (0.49) | HIF1ASMN1; SMN2PTPN1PTPRBPTPN2 | |
| SCHEMBL3383960 | 0.85 | SMN1; SMN2 (0.49) | HIF1ASMN1; SMN2PTPN1PTPRBPTPN2 | |
| SCHEMBL13108920 | 0.85 | SMN1; SMN2 (0.49) | HIF1ASMN1; SMN2PTPN1PTPRBPTPN2 | |
| SCHEMBL9208923 | 0.83 | SMN1; SMN2 (0.46) | HIF1ASMN1; SMN2PTPN1PTPRBPTPN2 | |
| SCHEMBL9208919 | 0.83 | SMN1; SMN2 (0.46) | HIF1ASMN1; SMN2PTPN1PTPRBPTPN2 | |
| SCHEMBL7513635 | 0.83 | PTPN1 (0.46) | HIF1ASMN1; SMN2PTPN1PTPRBPTPN2 |
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-1235807-A1 | B-AMINO ACID-, ASPARTIC ACID- AND DIAMINOPROPIONIC-BASED INHIBITORS OF FACTOR XA | Millennium Pharmaceuticals, Inc. (US) | 2002-09-04 | — | — | EP | disclosed |
| WO-2001038309-A1 | β-AMINO ACID-, ASPARTIC ACID- AND DIAMINOPROPIONIC-BASED INHIBITORS OF FACTOR Xa | COR THERAPEUTICS, INC. (US) | 2001-05-31 | — | — | WO | disclosed |