Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 2/20 | 0.48 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.48 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.48 |
| ▸ | TACR2 | P21452 | 2/20 | 0.48 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.48 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.48 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | SHBG | P04278 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.48 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.48 |
| ▸ | HTR2C | P28335 | 1/20 | 0.48 |
| ▸ | HSPE1 | P61604 | 1/20 | 0.48 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.48 |
| ▸ | TST | Q16762 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL10512613 | 0.91 | PTGS2 (0.50) | ESR1ADRA2AADORA3TACR2SLC6A2 | |
| SCHEMBL828819 | 0.91 | PTGS2 (0.50) | ESR1ADRA2AADORA3TACR2SLC6A2 | |
| SCHEMBL829405 | 0.91 | PTGS2 (0.50) | ESR1ADRA2AADORA3TACR2SLC6A2 | |
| SCHEMBL1778094 | 0.91 | PTGS2 (0.50) | ESR1ADRA2AADORA3TACR2SLC6A2 | |
| SCHEMBL4762927 | 0.89 | ESR1 (0.48) | ESR1ADRA2AADORA3TACR2SLC6A2 | |
| SCHEMBL4304642 | 0.89 | ESR1 (0.47) | ESR1ADRA2AADORA3TACR2SLC6A2 | |
| SCHEMBL2588081 | 0.84 | LPL (0.38) | ALDH1A1KDM4ELPLLIPGMGLL | |
| SCHEMBL1539433 | 0.82 | CA2 (0.42) | ESR1ADRA2AADORA3TACR2SLC6A2 | |
| SCHEMBL10962003 | 0.80 | DNM1 (0.46) | ESR1ADRA2AADORA3TACR2SLC6A2 | |
| SCHEMBL192374 | 0.79 | PTGS2 (0.50) | ESR1ADRA2AADORA3TACR2SLC6A2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1203089-C | New compound | FUJISAWA PHARMACEUTICAL CO (JP) | 2005-05-25 | — | — | CN | disclosed |
| CN-1168675-A | Novel compounds | FUJISAWA PHARMACEUTICAL CO (JP) | 1997-12-24 | — | — | CN | disclosed |
| EP-0788511-A1 | CYCLIC HEXAPEPTIDES HAVING ANTIBIOTIC ACTIVITY | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1997-08-13 | — | — | EP | disclosed |