Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 8/20 | 0.47 |
| ▸ | HRH2 | P25021 | 3/20 | 0.47 |
| ▸ | HRH1 | P35367 | 3/20 | 0.47 |
| ▸ | ACHE | P22303 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.39 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 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 | |
|---|---|---|---|---|
| SCHEMBL20729439 | 0.89 | HRH3 (0.49) | HRH3HRH2HRH1ACHE | |
| SCHEMBL24114470 | 0.89 | HRH3 (0.49) | HRH3HRH2HRH1ACHE | |
| SCHEMBL21309872 | 0.82 | HRH3 (0.46) | HRH3HRH2HRH1SIGMAR1SLC6A4 | |
| SCHEMBL12717293 | 0.80 | HRH3 (0.47) | HRH3HRH2HRH1ACHECYP3A4 | |
| SCHEMBL21738355 | 0.78 | HRH3 (0.46) | HRH3HRH2HRH1ACHECYP3A4 | |
| SCHEMBL20729442 | 0.78 | HTR1A (0.55) | HRH3HRH2HRH1ACHECYP3A4 | |
| SCHEMBL8897615 | 0.77 | SPHK1 (0.46) | HRH3HRH2HRH1ACHECYP3A4 | |
| SCHEMBL24556368 | 0.76 | HRH3 (0.52) | HRH3HRH1ACHEKCNH2ALDH1A1 | |
| SCHEMBL8501119 | 0.76 | HRH3 (0.43) | HRH3HRH2HRH1ACHECYP3A4 | |
| SCHEMBL21310147 | 0.75 | HRH3 (0.34) | HRH3HRH2HRH1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019165043-A2 | INDANE-AMINES AS PD-L1 ANTAGONISTS | CHEMOCENTRYX, INC. (US) | 2019-08-29 | — | — | WO | disclosed |
| WO-2019032547-A1 | MACROCYCLIC IMMUNOMODULATORS | CHEMOCENTRYX, INC. (US) | 2019-02-14 | — | — | WO | disclosed |