Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.47 |
| ▸ | ESR1 | P03372 | 2/20 | 0.42 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.42 |
| ▸ | TACR2 | P21452 | 2/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.42 |
| ▸ | NOS3 | P29474 | 2/20 | 0.42 |
| ▸ | NOS1 | P29475 | 2/20 | 0.42 |
| ▸ | NOS2 | P35228 | 2/20 | 0.42 |
| ▸ | ACHE | P22303 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | SHBG | P04278 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.42 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7864092 | 0.80 | HDAC3 (0.56) | ESR1ADRA2AADORA3TACR2SLC6A2 | |
| SCHEMBL31524115 | 0.80 | HRH3 (0.58) | HTR2AABAT | |
| SCHEMBL7864099 | 0.79 | MAPT (0.64) | SLC6A3ACHEALDH1A1MAPTRXFP1 | |
| SCHEMBL8123200 | 0.79 | MAPT (0.64) | SLC6A3ACHEALDH1A1MAPTRXFP1 | |
| SCHEMBL8108303 | 0.79 | MAPT (0.64) | SLC6A3ACHEALDH1A1MAPTRXFP1 | |
| SCHEMBL27367712 | 0.78 | MAPT (0.69) | SLC6A3HSD17B10TBXAS1S1PR1S1PR3 | |
| SCHEMBL920406 | 0.77 | HTR2A (0.76) | HTR2AESR1ADRA2AADORA3TACR2 | |
| SCHEMBL395308 | 0.77 | HTR2A (0.76) | HTR2AESR1ADRA2AADORA3TACR2 | |
| SCHEMBL21741595 | 0.77 | CA2 (0.58) | HTR2AESR1ADRA2AADORA3TACR2 | |
| SCHEMBL2674306 | 0.77 | HTR2A (0.76) | HTR2AESR1ADRA2AADORA3TACR2 |
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-102274527-A | Contrast agents for myocardial perfusion imaging | — | 2011-12-14 | — | — | CN | disclosed |
| CN-1925878-B | Contrast agents for myocardial perfusion imaging | BRISTOL MYERS SQUIBB PHARMA CO (US) | 2011-10-12 | — | — | CN | disclosed |
| CN-1925878-A | Contrast agents for myocardial perfusion imaging | BRISTOL MYERS SQUIBB PHARMA CO (US) | 2007-03-07 | — | — | CN | disclosed |