Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DNM1 | Q05193 | 6/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | APAF1 | O14727 | 1/20 | 0.43 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.43 |
| ▸ | RAD52 | P43351 | 1/20 | 0.43 |
| ▸ | ESR1 | P03372 | 2/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.41 |
| ▸ | TACR2 | P21452 | 2/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | SHBG | P04278 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.41 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL828819 | 0.89 | PTGS2 (0.50) | ESR1ADRA2AADORA3TACR2SLC6A2 | |
| SCHEMBL10512613 | 0.89 | PTGS2 (0.50) | ESR1ADRA2AADORA3TACR2SLC6A2 | |
| SCHEMBL1778094 | 0.89 | PTGS2 (0.50) | ESR1ADRA2AADORA3TACR2SLC6A2 | |
| SCHEMBL829405 | 0.89 | PTGS2 (0.50) | ESR1ADRA2AADORA3TACR2SLC6A2 | |
| SCHEMBL4762927 | 0.87 | ESR1 (0.48) | ESR1ADRA2AADORA3TACR2SLC6A2 | |
| SCHEMBL4304642 | 0.87 | ESR1 (0.47) | ESR1ADRA2AADORA3TACR2SLC6A2 | |
| SCHEMBL1539433 | 0.82 | CA2 (0.42) | ESR1ADRA2AADORA3TACR2SLC6A2 | |
| SCHEMBL8780465 | 0.80 | ESR1 (0.48) | ESR1ADRA2AADORA3TACR2SLC6A2 | |
| SCHEMBL21268375 | 0.77 | CA2 (0.37) | ESR1ADRA2AADORA3TACR2SLC6A2 | |
| Cetrimonium SCHEMBL28520718 | 0.74 | DNM1 (0.52) | DNM1KCNH2APAF1HSP90AA1RAD52 |
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 |
|---|---|---|---|---|---|---|---|
| JP-60105650-A | — | — | None | — | — | JP | disclosed |
| JP-S60105650-A | GLYCEROL DERIVATIVE, PRODUCTION THEREOF AND PHARMACEUTICAL CONTAINING SAID DERIVATIVE | ONO PHARMACEUT CO LTD | 1985-06-11 | — | — | JP | disclosed |