Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | BRD4 | O60885 | 1/20 | 0.38 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | BLM | P54132 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL2531549 | 0.85 | RAB9A (0.45) | RAB9APKMTDP1KMT2ASLC6A2 | |
| SCHEMBL27905200 | 0.83 | RAB9A (0.42) | RAB9APKMTDP1KMT2ASLC6A2 | |
| SCHEMBL27905298 | 0.82 | RAB9A (0.43) | RAB9APKMTDP1KMT2ASLC6A2 | |
| SCHEMBL2532336 | 0.79 | RAB9A (0.46) | RAB9APKMTDP1KMT2ASLC6A2 | |
| SCHEMBL28800742 | 0.72 | RAB9A (0.42) | RAB9APKMTDP1KMT2ASLC6A2 | |
| SCHEMBL2533630 | 0.70 | KMO (0.37) | KMT2ASLC6A3KDM4ETSHRMEN1 | |
| SCHEMBL2537355 | 0.69 | RAB9A (0.46) | RAB9APKMTDP1KMT2ASLC6A2 | |
| SCHEMBL2531304 | 0.67 | RAB9A (0.43) | RAB9APKMTDP1KMT2ASLC6A2 | |
| SCHEMBL2534316 | 0.67 | RAB9A (0.46) | RAB9APKMTDP1KMT2ASLC6A2 | |
| SCHEMBL312910 | 0.67 | TDP1 (0.81) | RAB9ATDP1KMT2ASLC6A2SLC6A3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102858746-B | Novel 3,3-dimethyl tetrahydroquinoline derivatives | HOFFMANN LA ROCHE | 2014-07-16 | — | — | CN | disclosed |
| CN-102858746-A | Novel 3,3-dimethyl tetrahydroquinoline derivatives | HOFFMANN LA ROCHE | 2013-01-02 | — | — | CN | disclosed |