Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | EGFR | P00533 | 2/20 | 0.40 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.40 |
| ▸ | IDO1 | P14902 | 1/20 | 0.39 |
| ▸ | PDGFRB | P09619 | 5/20 | 0.39 |
| ▸ | PDGFRA | P16234 | 5/20 | 0.39 |
| ▸ | FLT3 | P36888 | 3/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.39 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8802614 | 0.81 | ENPP2 (0.39) | CYP3A4TSHRIDO1PKMSMN1; SMN2 | |
| SCHEMBL8802820 | 0.81 | MEN1 (0.52) | MEN1KMT2AHDAC6CYP3A4CYP1A2 | |
| SCHEMBL8387112 | 0.73 | NLRP3 (0.45) | CYP3A4TUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL203679 | 0.72 | ALDH1A1 (0.61) | MEN1KMT2ACYP3A4TSHRPKM | |
| SCHEMBL2364416 | 0.72 | KDM4E (0.58) | MEN1KMT2ACYP3A4TSHRNPC1 | |
| SCHEMBL8387427 | 0.71 | TSHR (0.48) | MEN1KMT2AHDAC6CYP3A4TSHR | |
| SCHEMBL19592645 | 0.71 | ALOX15 (0.51) | MEN1KMT2ACYP1A2CYP2C9TSHR | |
| Hydrochloric Acid SCHEMBL25259767 | 0.70 | ALDH1A1 (0.59) | MEN1KMT2ACYP3A4TSHRPKM | |
| SCHEMBL17386357 | 0.70 | CYP3A4 (0.50) | CYP3A4TSHRPKMSMN1; SMN2 | |
| SCHEMBL27609022 | 0.69 | CYP3A4 (0.49) | CYP3A4TSHRPKMSMN1; 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 |
|---|---|---|---|---|---|---|---|
| EP-0804416-A1 | HETEROCYCLIC COMPOUNDS, USEFUL AS ALLOSTERIC EFFECTORS AT MUSCARINIC RECEPTORS | SANKYO COMPANY LIMITED (JP) | 1997-11-05 | — | — | EP | disclosed |