Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 3/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.42 |
| ▸ | GRM8 | O00222 | 1/20 | 0.41 |
| ▸ | GRM6 | O15303 | 1/20 | 0.41 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 3/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.41 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL4904700 | 0.78 | HDAC8 (0.66) | KMT2AKDM4EMEN1MAPTGRM8 | |
| SCHEMBL4904692 | 0.78 | HDAC8 (0.66) | KMT2AKDM4EMEN1MAPTGRM8 | |
| SCHEMBL4730009 | 0.78 | EPHX1 (0.55) | KMT2AMEN1SIGMAR1EPHX1 | |
| SCHEMBL30239684 | 0.78 | DPP4 (0.44) | KMT2AMEN1ALDH1A1SMN1; SMN2 | |
| SCHEMBL30762196 | 0.77 | TSHR (0.56) | KMT2AKDM4EMEN1MAPTALDH1A1 | |
| SCHEMBL16836911 | 0.76 | TSHR (0.54) | ALDH1A1TSHRGRM8GRM6GRM4 | |
| SCHEMBL6188426 | 0.76 | TSHR (0.54) | ALDH1A1TSHRGRM8GRM6GRM4 | |
| SCHEMBL30537970 | 0.76 | TSHR (0.54) | ALDH1A1TSHRGRM8GRM6GRM4 | |
| SCHEMBL6191530 | 0.76 | TSHR (0.54) | ALDH1A1TSHRGRM8GRM6GRM4 | |
| SCHEMBL6961010 | 0.74 | TAAR1 (0.57) | KMT2AKDM4EMEN1MAPTALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1996550-A2 | CARBOXYAMINE COMPOUNDS AND THEIR USE IN THE TREATMENT OF HDAC DEPENDENT DISEASES | Novartis AG (CH) | 2008-12-03 | — | — | EP | disclosed |
| WO-2007038459-A2 | CARBOXYAMINE COMPOUNDS AND THEIR USE IN THE TREATMENT OF HDAC DEPENDENT DISEASES | NOVARTIS AG (CH) | 2007-04-05 | — | — | WO | disclosed |