Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.40 |
| ▸ | ACACB | O00763 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | TGM2 | P21980 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | GSTO1 | P78417 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4595706 | 0.82 | HCAR2 (0.46) | HCAR2CYP2C19HTTALDH1A1KMT2A | |
| SCHEMBL24708816 | 0.81 | THRB (0.43) | HCAR2TGM2TDP1CYP2C19ALDH1A1 | |
| SCHEMBL23666712 | 0.78 | ELANE (0.49) | ACACBALDH1A1 | |
| SCHEMBL17310391 | 0.77 | CYP2C19 (0.53) | TSHRTGM2TDP1CYP2C19ALDH1A1 | |
| SCHEMBL17310390 | 0.77 | CYP2C19 (0.53) | TSHRTGM2TDP1CYP2C19ALDH1A1 | |
| SCHEMBL5580239 | 0.77 | KDM4E (0.45) | HCAR2CYP2C19ALDH1A1KMT2ACYP3A4 | |
| SCHEMBL5087975 | 0.75 | HCAR2 (0.41) | HCAR2CYP2C19HTTALDH1A1KMT2A | |
| Hydrochloric Acid SCHEMBL7722976 | 0.75 | ALDH1A1 (0.44) | HCAR2CYP2C19ALDH1A1KMT2ACYP3A4 | |
| SCHEMBL28863896 | 0.75 | HCAR2 (0.67) | HCAR2CYP2C19ALDH1A1KMT2ACYP3A4 | |
| SCHEMBL4415392 | 0.75 | TDP1 (0.63) | ACACBTSHRTDP1ALDH1A1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-8021893-B2 | Molecular recognition polymer enabling reconstruction of recognition field for target molecule and method of producing the same | JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) | 2011-09-20 | — | — | US | disclosed |
| US-20090053825-A1 | MOLECULAR RECOGNITION POLYMER ENABLING RECONSTRUCTION OF RECOGNITION FIELD FOR TARGET MOLECULE AND METHOD OF PRODUCING THE SAME | JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) | 2009-02-26 | — | — | US | disclosed |