Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.34 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.34 |
| ▸ | FAAH | O00519 | 2/20 | 0.32 |
| ▸ | MGLL | Q99685 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.31 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.31 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.31 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.31 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7566172 | 0.98 | CA1 (0.34) | CA1CA2CA12CA9GABRA1 | |
| SCHEMBL9066417 | 0.79 | NPC1 (0.33) | TSHR | |
| Hydrochloric Acid SCHEMBL7566926 | 0.77 | NPC1 (0.32) | TSHR | |
| Hydrochloric Acid SCHEMBL27515129 | 0.76 | CA1 (0.35) | CA1CA2CA12CA9GABRA1 | |
| Hydrochloric Acid SCHEMBL27515128 | 0.76 | CA1 (0.35) | CA1CA2CA12CA9GABRA1 | |
| SCHEMBL9066114 | 0.75 | CYP2D6 (0.36) | GABRA1GABRB2MGLLLMNATSHR | |
| Hydrochloric Acid SCHEMBL7566166 | 0.75 | CA1 (0.37) | CA1CA2CA12CA9GABRA1 | |
| SCHEMBL7740532 | 0.74 | ALDH1A1 (0.33) | — | |
| Hydrochloric Acid SCHEMBL7567523 | 0.73 | CYP2D6 (0.35) | MGLLLMNATRPA1 | |
| SCHEMBL29002030 | 0.72 | CA12 (0.33) | CA1CA2CA12CA9GABRA1 |
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-0540108-B1 | Catalyst composition | SHELL INT RESEARCH (NL) | 1996-01-03 | — | — | EP | claimed |