Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 1/20 | 0.35 |
| ▸ | TACR1 | P25103 | 2/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.34 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.34 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.34 |
| ▸ | MCOLN3 | Q8TDD5 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6541082 | 1.00 | EPHX2 (0.35) | EPHX2TACR1TP53ALDH1A1MAPT | |
| SCHEMBL7198698 | 1.00 | EPHX2 (0.35) | EPHX2TACR1TP53ALDH1A1MAPT | |
| SCHEMBL6540204 | 0.88 | TACR1 (0.42) | TACR1KMT2A | |
| SCHEMBL6541358 | 0.84 | PLA2G1B (0.36) | TACR1ALDH1A1MAPTMCOLN3KDM4E | |
| Hydrochloric Acid SCHEMBL6540431 | 0.81 | TACR1 (0.46) | TACR1HTTKDM4EKMT2A | |
| Hydrochloric Acid SCHEMBL7200284 | 0.81 | TACR1 (0.46) | TACR1HTTKDM4EKMT2A | |
| Hydrochloric Acid SCHEMBL7200288 | 0.81 | TACR1 (0.46) | TACR1HTTKDM4EKMT2A | |
| Hydrochloric Acid SCHEMBL6541744 | 0.80 | TACR1 (0.39) | TACR1ALDH1A1GAAKMT2A | |
| Hydrochloric Acid SCHEMBL7197850 | 0.80 | TACR1 (0.39) | TACR1ALDH1A1GAAKMT2A | |
| Hydrochloric Acid SCHEMBL7197854 | 0.80 | TACR1 (0.39) | TACR1ALDH1A1GAAKMT2A |
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-1294700-A2 | BENZHYDRYL DERIVATIVES | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2003-03-26 | — | — | EP | disclosed |
| WO-2002000631-A2 | BENZHYDRYL DERIVATIVES | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2002-01-03 | — | — | WO | disclosed |