Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.39 |
| ▸ | ALKBH1 | Q13686 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | BRD4 | O60885 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.37 |
| ▸ | TK1 | P04183 | 1/20 | 0.36 |
| ▸ | VCP | P55072 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL5460039 | 0.86 | TSHR (0.40) | TSHRALDH1A1PTGER1ALKBH1MEN1 | |
| SCHEMBL5359814 | 0.85 | HDAC1 (0.43) | TSHRALDH1A1PTGER1ALKBH1MEN1 | |
| SCHEMBL15074567 | 0.79 | ALDH1A1 (0.46) | TSHRALDH1A1MEN1KMT2AL3MBTL1 | |
| SCHEMBL5356970 | 0.78 | NPC1 (0.48) | ALDH1A1PTGER1MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL259686 | 0.78 | HDAC1 (0.48) | TSHRALDH1A1L3MBTL1SMN1; SMN2NPC1 | |
| SCHEMBL27796924 | 0.75 | SRD5A1 (0.43) | L3MBTL1SMN1; SMN2NPC1RAB9ACYP19A1 | |
| SCHEMBL26690066 | 0.74 | DGAT1 (0.43) | PTGER1ALKBH1MEN1KMT2AL3MBTL1 | |
| SCHEMBL12126144 | 0.73 | L3MBTL1 (0.33) | ALDH1A1L3MBTL1SMN1; SMN2 | |
| SCHEMBL20675615 | 0.71 | ALDH1A1 (0.47) | TSHRALDH1A1ALKBH1MEN1KMT2A | |
| SCHEMBL23115952 | 0.70 | MEN1 (0.48) | PTGER1MEN1KMT2AL3MBTL1SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007145349-A2 | SUBSTITUTED PYRROLE DERIVATIVES | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2007-12-21 | — | — | WO | disclosed |