Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.50 |
| ▸ | CA9 | Q16790 | 2/20 | 0.50 |
| ▸ | CA1 | P00915 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | TGM2 | P21980 | 2/20 | 0.39 |
| ▸ | CTSB | P07858 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | F13A1 | P00488 | 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 | |
|---|---|---|---|---|
| SCHEMBL43967 | 0.79 | HCAR2 (0.59) | CA12CA9ALDH1A1HCAR2TDP1 | |
| SCHEMBL27854927 | 0.76 | CA12 (0.55) | CA12CA9CA1CA2ALDH1A1 | |
| SCHEMBL28218969 | 0.72 | CA12 (0.65) | CA12CA9CA1CA2ALDH1A1 | |
| SCHEMBL1722105 | 0.72 | CA12 (0.65) | CA12CA9CA1CA2ALDH1A1 | |
| SCHEMBL8494440 | 0.71 | FABP7 (0.51) | ALDH1A1HCAR2TDP1MAPK1L3MBTL1 | |
| SCHEMBL8494439 | 0.71 | FABP7 (0.51) | ALDH1A1HCAR2TDP1MAPK1L3MBTL1 | |
| SCHEMBL28419926 | 0.71 | ALDH1A1 (0.60) | CA12CA9CA1CA2ALDH1A1 | |
| SCHEMBL29057819 | 0.71 | CA12 (0.59) | CA12CA9CA1CA2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL11753023 | 0.70 | CA12 (0.63) | CA12CA9CA1CA2ALDH1A1 | |
| SCHEMBL7520802 | 0.69 | ALDH1A1 (0.56) | CA12CA9ALDH1A1HCAR2TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011157444-A1 | FUNCTIONALIZED MATERIALS BY CATALYZED CARBENE COPOLYMERIZATION | STICHTING DUTCH POLYMER INSTITUTE (NL) | 2011-12-22 | — | — | WO | disclosed |