Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | DRD1 | P21728 | 5/20 | 0.38 |
| ▸ | DRD5 | P21918 | 5/20 | 0.38 |
| ▸ | DRD3 | P35462 | 5/20 | 0.38 |
| ▸ | DRD2 | P14416 | 4/20 | 0.38 |
| ▸ | DRD4 | P21917 | 3/20 | 0.38 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.36 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.36 |
| ▸ | KIF11 | P52732 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | MAOA | P21397 | 2/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | HTR2A | P28223 | 2/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6904765 | 0.86 | DRD1 (0.42) | CA2TSHRALDH1A1TDP1DRD1 | |
| SCHEMBL9419793 | 0.80 | CYP1A2 (0.46) | CA2TSHRALDH1A1TDP1GABRA1 | |
| SCHEMBL2043313 | 0.80 | PNMT (0.49) | CA2TSHRALDH1A1TDP1DRD3 | |
| SCHEMBL28259616 | 0.79 | CHRNB2 (0.40) | TSHRALDH1A1TDP1DRD1DRD5 | |
| P-Cresol SCHEMBL11350328 | 0.78 | ACHE (0.43) | CA2TSHRALDH1A1TDP1GABRA1 | |
| SCHEMBL28955940 | 0.76 | NPC1 (0.43) | CA2TSHRALDH1A1TDP1KIF11 | |
| SCHEMBL2834108 | 0.76 | MAOA (0.53) | CA2TSHRALDH1A1TDP1GABRA1 | |
| SCHEMBL27835838 | 0.75 | PNMT (0.47) | CA2TSHRALDH1A1TDP1DRD3 | |
| SCHEMBL29638023 | 0.74 | MAPKAPK2 (0.38) | CA2TSHRALDH1A1TDP1DRD1 | |
| SCHEMBL24871632 | 0.74 | CA2 (0.44) | CA2TSHRALDH1A1TDP1DRD1 |
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-6815481-B2 | FUSED DIBENZO THERMAL STABILIZERS SUCH AS ANTHRACENE, XANTHENE AND ANTHRONE | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2004-11-09 | — | — | US | disclosed |
| US-20020032256-A1 | Polybutadiene composition | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2002-03-14 | — | — | US | disclosed |