Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 2/20 | 0.43 |
| ▸ | CA1 | P00915 | 2/20 | 0.43 |
| ▸ | CA2 | P00918 | 2/20 | 0.43 |
| ▸ | CA9 | Q16790 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | IDO1 | P14902 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | AGXT | P21549 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL21164212 | 0.81 | TGM2 (0.47) | ALDH1A1HCAR2CA12CA1CA2 | |
| SCHEMBL21907075 | 0.77 | ALDH1A1 (0.41) | ALDH1A1HCAR2CA12CA1CA2 | |
| SCHEMBL14609573 | 0.73 | HCAR2 (0.65) | ALDH1A1HCAR2CA12CA1CA2 | |
| SCHEMBL12658032 | 0.73 | ALDH1A1 (0.44) | ALDH1A1HCAR2CA12CA1CA2 | |
| SCHEMBL22394368 | 0.72 | ALDH1A1 (0.55) | ALDH1A1HCAR2CA12CA1CA2 | |
| SCHEMBL8320568 | 0.72 | ALDH1A1 (0.50) | ALDH1A1HCAR2CA12CA1CA2 | |
| SCHEMBL17779954 | 0.72 | ALDH1A1 (0.50) | ALDH1A1HCAR2CA12CA1CA2 | |
| SCHEMBL17177756 | 0.70 | ALDH1A1 (0.57) | ALDH1A1HCAR2CA12CA1CA2 | |
| SCHEMBL320969 | 0.70 | ALDH1A1 (0.52) | ALDH1A1CA12CA1CA2CA9 | |
| SCHEMBL219575 | 0.69 | HCAR2 (0.65) | ALDH1A1HCAR2CA12CA9MAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| US-8420641-B2 | Method of inhibiting CETP activity with 4-benzylamino-1-carboxylacyl-piperidine derivatives | NOVARTIS AG (CH) | 2013-04-16 | — | — | US | disclosed |