Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.48 |
| ▸ | HTR2A | P28223 | 4/20 | 0.47 |
| ▸ | HTR2C | P28335 | 4/20 | 0.47 |
| ▸ | HTR2B | P41595 | 4/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | PBRM1 | Q86U86 | 6/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.33 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL12718314 | 0.81 | HTR2A (0.51) | CYP1A2HTR2AHTR2CHTR2BHSD17B10 | |
| SCHEMBL11358191 | 0.78 | HTR2A (0.46) | CYP1A2HTR2AHTR2CHTR2BHSD17B10 | |
| SCHEMBL13995842 | 0.76 | HSD17B10 (0.71) | CYP1A2HTR2AHTR2CHTR2BHSD17B10 | |
| SCHEMBL11358726 | 0.74 | HTR2A (0.54) | CYP1A2HTR2AHTR2CHTR2BPBRM1 | |
| SCHEMBL12716352 | 0.72 | HTR2A (0.55) | CYP1A2HTR2AHTR2CHTR2BPBRM1 | |
| SCHEMBL29010215 | 0.71 | HTR2A (0.51) | CYP1A2HTR2AHTR2CHTR2BPBRM1 | |
| SCHEMBL3748724 | 0.71 | HTR2A (0.48) | CYP1A2HTR2AHTR2CHTR2BHSD17B10 | |
| SCHEMBL11352016 | 0.71 | KDM4E (0.47) | CYP1A2HSD17B10GAAALDH1A1HPGD | |
| SCHEMBL11367617 | 0.71 | CYP1A2 (0.66) | CYP1A2HTR2AHTR2CHTR2BHSD17B10 | |
| SCHEMBL11363644 | 0.71 | CYP1A2 (0.66) | CYP1A2HSD17B10PBRM1ALDH1A1HPGD |
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 |
|---|---|---|---|---|---|---|---|
| US-4244966-A | 1,3-Dihydro-3-(2-hydroxy-, 2-bromo- or 2-chloroethyl)-2H-isoindol-1-one derivatives | AMERICAN HOME PRODUCTS CORPORATION (US) | 1981-01-13 | — | — | US | disclosed |