Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | CA2 | P00918 | 2/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA4 | P22748 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.36 |
| ▸ | CES2 | O00748 | 1/20 | 0.36 |
| ▸ | CES1 | P23141 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| Formic Acid SCHEMBL28150588 | 0.88 | CA12 (0.46) | CA1CA2CA12CA4CA9 | |
| SCHEMBL166276 | 0.85 | — | — | |
| Hydrochloric Acid SCHEMBL28636364 | 0.83 | LMNA (0.47) | CA1CA2CA12CA4CA9 | |
| Bromide SCHEMBL31124594 | 0.83 | LMNA (0.47) | CA1CA2CA12CA4CA9 | |
| 1,4-Dichlorobenzene SCHEMBL27440392 | 0.80 | HSD17B10 (0.58) | HSD17B10CA1CA2LMNACYP2A6 | |
| SCHEMBL27762467 | 0.78 | CYP1A2 (0.48) | CA1CA2CA12CA4CA9 | |
| Formic Acid SCHEMBL29096106 | 0.77 | ALDH1A1 (0.41) | CA1CA2CA12CA4CA9 | |
| Phenylacetylene SCHEMBL27256635 | 0.76 | PTPN1 (0.39) | CA1CA2CA12CA4CA9 | |
| SCHEMBL7106722 | 0.73 | MAOA (0.52) | CA2CA9CA14LMNAMAPT | |
| SCHEMBL4026476 | 0.72 | CHRM2 (0.50) | CA1CA2CA12CA4CA9 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101883762-A | Benzothiazoles as modulators of growth hormone releasing hormone receptors | ASTRAZENECA AB | 2010-11-10 | — | — | CN | disclosed |