Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.45 |
| ▸ | MEN1 | O00255 | 4/20 | 0.45 |
| ▸ | FAAH | O00519 | 2/20 | 0.45 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL29252729 | 0.86 | AGTR2 (0.48) | ALDH1A1MAPK1KMT2AMEN1FAAH | |
| SCHEMBL28534918 | 0.86 | ACACB (0.46) | HTR1AALDH1A1KDM4EMAPK1KMT2A | |
| SCHEMBL16371697 | 0.84 | GFER (0.47) | L3MBTL1ALDH1A1KDM4EMAPK1HTT | |
| SCHEMBL4225875 | 0.84 | AKR1C3 (0.40) | KMT2AMEN1FAAHAKR1C3 | |
| SCHEMBL4757742 | 0.82 | ALDH1A1 (0.47) | ALDH1A1KDM4EKMT2AMEN1SMN1; SMN2 | |
| SCHEMBL17923089 | 0.82 | AGTR2 (0.37) | ALDH1A1KMT2AMEN1 | |
| SCHEMBL21224830 | 0.81 | SLC6A7 (0.40) | KDM4EMAPTTSHRGAA | |
| SCHEMBL28036149 | 0.81 | SLC6A9 (0.40) | HTTLMNAPOLBSMN1; SMN2GAA | |
| SCHEMBL16752913 | 0.81 | SLC6A9 (0.40) | — | |
| SCHEMBL29037717 | 0.81 | MEN1 (0.45) | L3MBTL1ALDH1A1KDM4EKMT2AMEN1 |
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-104968654-A | Substituted 2-aminopyridine protein kinase inhibitor | CHIA TAI TIANQING PHARMACEUTICAL GROUP CO LTD | 2015-10-07 | — | — | CN | disclosed |