Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | TSHR | P16473 | 6/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | CCR6 | P51684 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | GPR35 | Q9HC97 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | NLRP1 | Q9C000 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL20942956 | 0.85 | CYP1A2 (0.47) | CYP1A2TSHRSMN1; SMN2TDP1HSD17B10 | |
| SCHEMBL31065888 | 0.83 | CYP1A2 (0.46) | CYP1A2TSHRSMN1; SMN2TDP1HSD17B10 | |
| SCHEMBL31065893 | 0.83 | CYP1A2 (0.46) | CYP1A2TSHRSMN1; SMN2TDP1HSD17B10 | |
| SCHEMBL3345371 | 0.80 | GPR35 (0.47) | CYP1A2TSHRSMN1; SMN2TDP1HSD17B10 | |
| SCHEMBL20505233 | 0.80 | TSHR (0.47) | CYP1A2TSHRSMN1; SMN2TDP1HSD17B10 | |
| SCHEMBL3016826 | 0.80 | GPR35 (0.57) | CYP1A2TDP1HSD17B10ALDH1A1RECQL | |
| SCHEMBL13636526 | 0.80 | ALDH1A1 (0.47) | CYP1A2TSHRTDP1HSD17B10CCR6 | |
| SCHEMBL25063738 | 0.80 | L3MBTL1 (0.51) | CYP1A2TSHRSMN1; SMN2TDP1ALDH1A1 | |
| SCHEMBL21395479 | 0.80 | ALDH1A1 (0.50) | CYP1A2TSHRSMN1; SMN2TDP1HSD17B10 | |
| SCHEMBL9676449 | 0.78 | TDP1 (0.50) | CYP1A2TSHRSMN1; SMN2TDP1HSD17B10 |
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-2906565-B1 | POROUS CRYSTALLINE FRAMEWORKS, PROCESS FOR THE PREPARATION THEROF AND THEIR MECHANICAL DELAMINATION TO COVALENT ORGANIC NANOSHEETS (CONS) | COUNCIL SCIENT IND RES (IN) | 2016-10-26 | — | — | EP | disclosed |