Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | NOS1 | P29475 | 2/20 | 0.34 |
| ▸ | NOS3 | P29474 | 1/20 | 0.34 |
| ▸ | NOS2 | P35228 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.33 |
| ▸ | ITGB7 | P26010 | 1/20 | 0.33 |
| ▸ | GABRR1 | P24046 | 2/20 | 0.32 |
| ▸ | CTSK | P43235 | 4/20 | 0.32 |
| ▸ | CTSS | P25774 | 3/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CA7 | P43166 | 1/20 | 0.32 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL22315823 | 0.88 | CPB2 (0.41) | MEN1KMT2ATDP1POLBNPSR1 | |
| SCHEMBL14742867 | 0.85 | MEN1 (0.38) | MEN1KMT2AGAANOS1NOS3 | |
| SCHEMBL743729 | 0.85 | MAPT (0.35) | MEN1KMT2AGAANOS1NOS3 | |
| SCHEMBL2611916 | 0.83 | GRN (0.36) | MEN1KMT2AGAANOS1NOS3 | |
| SCHEMBL22156688 | 0.83 | CTSK (0.45) | MEN1KMT2AGAAALDH1A1MAPT | |
| SCHEMBL19932155 | 0.83 | TDP1 (0.37) | MEN1KMT2AGAANOS1NOS3 | |
| SCHEMBL7403195 | 0.82 | FNTA (0.36) | MEN1KMT2AGAANOS1NOS3 | |
| SCHEMBL9555164 | 0.82 | CTSK (0.46) | TDP1CTSKCTSSCA1CA2 | |
| SCHEMBL2620497 | 0.82 | CTSK (0.46) | TDP1CTSKCTSSCA1CA2 | |
| Hydrochloric Acid SCHEMBL1094813 | 0.81 | CTSK (0.44) | TDP1CTSKCTSSCA1CA2 |
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-2247588-A2 | FUSED HETEROCYCLIC DERIVATIVE AND USE THEREOF | Takeda Pharmaceutical Company Limited (JP) | 2010-11-10 | — | — | EP | disclosed |
| WO-2009107850-A2 | FUSED HETEROCYCLIC DERIVATIVE AND USE THEREOF | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2009-09-03 | — | — | WO | disclosed |