Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRA | P10827 | 5/20 | 0.44 |
| ▸ | THRB | P10828 | 5/20 | 0.44 |
| ▸ | ATG4B | Q9Y4P1 | 12/20 | 0.43 |
| ▸ | PLA2G1B | P04054 | 10/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | SHBG | P04278 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.40 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.40 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9337721 | 0.88 | SMN1; SMN2 (0.39) | TDP1MEN1KMT2AALDH1A1LMNA | |
| SCHEMBL10498423 | 0.87 | THRA (0.47) | THRATHRBATG4BPLA2G1BCYP1A2 | |
| SCHEMBL10497881 | 0.87 | THRA (0.47) | THRATHRBATG4BPLA2G1BCYP1A2 | |
| SCHEMBL10498105 | 0.85 | THRA (0.47) | THRATHRBATG4BPLA2G1BCYP1A2 | |
| SCHEMBL10498768 | 0.81 | THRA (0.47) | THRATHRBATG4BPLA2G1BCYP1A2 | |
| SCHEMBL10499047 | 0.80 | THRA (0.44) | THRATHRBATG4BPLA2G1BCYP1A2 | |
| SCHEMBL9338240 | 0.78 | THRA (0.49) | THRATHRBATG4BPLA2G1BCYP1A2 | |
| SCHEMBL10497948 | 0.77 | THRA (0.46) | THRATHRBATG4BPLA2G1BCYP1A2 | |
| SCHEMBL9341461 | 0.76 | PLA2G1B (0.47) | THRATHRBATG4BPLA2G1BCYP1A2 | |
| SCHEMBL10497563 | 0.76 | THRA (0.45) | THRATHRBATG4BPLA2G1BCYP1A2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0328669-A1 | CHALCONE DERIVATIVE COMPOUNDS | NIPPON OIL AND FATS COMPANY, LIMITED (JP) | 1989-08-23 | — | — | EP | disclosed |