Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 7/20 | 0.60 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.54 |
| ▸ | APP | P05067 | 1/20 | 0.54 |
| ▸ | CALM1 | P0DP23 | 3/20 | 0.51 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.50 |
| ▸ | CA1 | P00915 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | HTR1A | P08908 | 2/20 | 0.49 |
| ▸ | DRD2 | P14416 | 2/20 | 0.49 |
| ▸ | NOS2 | P35228 | 1/20 | 0.48 |
| ▸ | MAOB | P27338 | 1/20 | 0.47 |
| ▸ | JAK2 | O60674 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL8723684 | 0.89 | ABCB1 (0.53) | ABCB1PTPN1APPCALM1ENPP2 | |
| SCHEMBL7909609 | 0.89 | ABCB1 (0.56) | ABCB1PTPN1CALM1ENPP2TP53 | |
| SCHEMBL8721199 | 0.88 | ABCB1 (0.49) | ABCB1PTPN1APPCALM1ENPP2 | |
| SCHEMBL7909614 | 0.86 | ABCB1 (0.53) | ABCB1PTPN1CALM1ENPP2HTR1A | |
| SCHEMBL8723189 | 0.85 | ABCB1 (0.52) | ABCB1PTPN1CALM1ENPP2TSHR | |
| SCHEMBL11083926 | 0.85 | APP (0.65) | ABCB1APPCA1CA2TP53 | |
| SCHEMBL8241510 | 0.81 | ABCB1 (0.61) | ABCB1PTPN1CALM1ENPP2HTR1A | |
| SCHEMBL10183792 | 0.81 | LIPE (0.66) | ABCB1PTPN1CALM1ENPP2HTR1A | |
| SCHEMBL2549427 | 0.80 | ABCB1 (0.60) | ABCB1PTPN1ENPP2HTR1ADRD2 | |
| SCHEMBL5839701 | 0.78 | ABCB1 (0.58) | ABCB1PTPN1LMNAGAAALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6225352-B1 | USEFUL AS AGENTS IN THE TREATMENT OF CANCER, ALZHEIMERS DISEASE, THROMBOSIS, INFLAMMATORY DISEASES, AND BACTERIAL RESISTANCE | WARNER-LAMBERT COMPANY | 2001-05-01 | — | — | US | disclosed |
| WO-1998006691-A2 | LOW MOLECULAR WEIGHT DENDRITIC COMPOUNDS AS PHARMACEUTICAL AGENTS | WARNER-LAMBERT COMPANY (US) | 1998-02-19 | — | — | WO | disclosed |