Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.40 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.40 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.40 |
| ▸ | PDE2A | O00408 | 2/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.37 |
| ▸ | TACR3 | P29371 | 3/20 | 0.37 |
| ▸ | GRM5 | P41594 | 3/20 | 0.35 |
| ▸ | P2RX7 | Q99572 | 6/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | TACR2 | P21452 | 2/20 | 0.33 |
| ▸ | TACR1 | P25103 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL20042986 | 1.00 | TAS1R3 (0.40) | TAS1R3TAS1R1TAS1R2PDE2AKCNH2 | |
| SCHEMBL20042868 | 0.90 | P2RX7 (0.35) | KCNH2TACR3GRM5P2RX7TP53 | |
| SCHEMBL20042939 | 0.86 | GRM5 (0.40) | KCNH2TACR3GRM5P2RX7 | |
| SCHEMBL20042853 | 0.86 | GPR6 (0.34) | KCNH2TACR3P2RX7TP53THRB | |
| SCHEMBL20042852 | 0.85 | TACR3 (0.47) | TAS1R3TAS1R1TAS1R2PDE2AKCNH2 | |
| SCHEMBL20042898 | 0.85 | TACR3 (0.45) | KCNH2TACR3GRM5P2RX7TDP1 | |
| SCHEMBL20042841 | 0.85 | TACR2 (0.45) | KCNH2TACR3GRM5TP53THRB | |
| SCHEMBL20042958 | 0.85 | TACR3 (0.42) | KCNH2TACR3TACR2 | |
| SCHEMBL20042865 | 0.85 | TACR3 (0.42) | KCNH2TACR3TACR2 | |
| SCHEMBL20042982 | 0.85 | P2RX7 (0.46) | KCNH2TACR3P2RX7TP53THRB |
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 |