Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.45 |
| ▸ | USP2 | O75604 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | THRB | P10828 | 2/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL3170296 | 0.88 | SMN1; SMN2 (0.43) | SMN1; SMN2MAPK1USP2POLBKDM4E | |
| SCHEMBL3170897 | 0.86 | GRM5 (0.42) | SMN1; SMN2TSHRALOX15ALDH1A1 | |
| SCHEMBL3171977 | 0.85 | ALDH1A1 (0.45) | SMN1; SMN2MAPK1POLBTSHRLMNA | |
| SCHEMBL3165730 | 0.83 | RORC (0.44) | MAPK1POLBKDM4ELMNAMEN1 | |
| SCHEMBL3163995 | 0.82 | KDM4E (0.50) | SMN1; SMN2POLBKDM4ETSHRLMNA | |
| SCHEMBL3175358 | 0.81 | CHRM1 (0.40) | SMN1; SMN2 | |
| SCHEMBL4802865 | 0.78 | DRD2 (0.49) | SMN1; SMN2KDM4ETSHRLMNAMEN1 | |
| SCHEMBL3167885 | 0.78 | HTT (0.38) | POLBTSHRLMNAMAPT | |
| SCHEMBL3156925 | 0.78 | MAPT (0.53) | SMN1; SMN2POLBKDM4ELMNAMEN1 | |
| SCHEMBL3157547 | 0.77 | CHRM3 (0.44) | KDM4ETSHRMEN1KMT2AALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1716128-B1 | SUBSTITUTED 4,5,6,7-TETRAHYDRO-BENZOTHIAZOL-2-YLAMINE COMPOUNDS | GRUENENTHAL GMBH (DE) | 2010-03-31 | — | — | EP | claimed |