Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MMP9 | P14780 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 3/20 | 0.36 |
| ▸ | CA2 | P00918 | 3/20 | 0.36 |
| ▸ | CA9 | Q16790 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.35 |
| ▸ | PPARG | P37231 | 1/20 | 0.34 |
| ▸ | PPARD | Q03181 | 1/20 | 0.34 |
| ▸ | PPARA | Q07869 | 1/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.33 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.33 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
| ▸ | MMP2 | P08253 | 3/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2903095 | 0.80 | MAPT (0.51) | ALDH1A1KDM4EUSP2LMNAMMP9 | |
| SCHEMBL7959199 | 0.80 | ALDH1A1 (0.51) | ALDH1A1KDM4EUSP2LMNAMMP9 | |
| SCHEMBL3871947 | 0.79 | ACACB (0.39) | ALDH1A1KDM4EUSP2LMNAMMP9 | |
| SCHEMBL23015043 | 0.79 | ALDH1A1 (0.46) | ALDH1A1KDM4EUSP2LMNAMMP9 | |
| SCHEMBL7417122 | 0.78 | TSHR (0.47) | ALDH1A1KDM4EUSP2LMNAMMP9 | |
| SCHEMBL2962876 | 0.77 | TSHR (0.50) | ALDH1A1KDM4EUSP2LMNAMMP9 | |
| SCHEMBL21623467 | 0.76 | CYP2A6 (0.43) | ALDH1A1TSHRCA1CA2CA9 | |
| SCHEMBL21623418 | 0.76 | CYP2A6 (0.43) | ALDH1A1TSHRCA1CA2CA9 | |
| SCHEMBL11477234 | 0.75 | PTPN2 (0.37) | ALDH1A1KDM4EUSP2LMNAMMP9 | |
| SCHEMBL25270396 | 0.75 | HDAC1 (0.56) | ALDH1A1KDM4EMMP9MAPTMMP2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5552431-A | ANTICOAGULANTS | G. D. SEARLE & CO. (US) | 1996-09-03 | — | — | US | disclosed |
| US-5424334-A | Peptide mimetic compounds useful as platelet aggregation inhibitors | G. D. SEARLE & CO. (US) | 1995-06-13 | — | — | US | disclosed |
| WO-1993012074-A1 | PEPTIDE MIMETIC COMPOUNDS USEFUL AS PLATELET AGGREGATION INHIBITORS | G.D. SEARLE & CO. (US) | 1993-06-24 | — | — | WO | disclosed |