Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | DPP4 | P27487 | 1/20 | 0.43 |
| ▸ | C5AR1 | P21730 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | CLPP | Q16740 | 6/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | PARP1 | P09874 | 1/20 | 0.36 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.36 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | MC4R | P32245 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL20042770 | 0.82 | CYP2C19 (0.49) | CYP2C19CYP3A4DPP4C5AR1MEN1 | |
| SCHEMBL20042893 | 0.80 | CYP2C19 (0.45) | CYP2C19CYP3A4DPP4C5AR1MEN1 | |
| SCHEMBL5999840 | 0.73 | KMT2A (0.56) | C5AR1MEN1KMT2ACLPPGAA | |
| SCHEMBL183618 | 0.71 | P2RX7 (0.53) | C5AR1MEN1KMT2AGAAPARP1 | |
| SCHEMBL16260721 | 0.70 | KMT2A (0.59) | C5AR1MEN1KMT2ACLPPCYP1A2 | |
| Hydrochloric Acid SCHEMBL6298078 | 0.70 | P2RX7 (0.52) | C5AR1MEN1KMT2AGAAPARP1 | |
| SCHEMBL1832111 | 0.69 | C5AR1 (0.53) | CYP2C19CYP3A4DPP4C5AR1MEN1 | |
| SCHEMBL13329574 | 0.68 | KMT2A (0.56) | C5AR1MEN1KMT2ACLPPCYP1A2 | |
| Hydrochloric Acid SCHEMBL4321708 | 0.68 | C5AR1 (0.52) | CYP2C19CYP3A4DPP4C5AR1MEN1 | |
| SCHEMBL4468023 | 0.68 | KDM4E (0.59) | MEN1KMT2ALMNA |
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-2018066718-A1 | THERAPEUTIC COMPOUNDS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2018-04-12 | — | — | WO | disclosed |