Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 2/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.37 |
| ▸ | ESR1 | P03372 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.34 |
| ▸ | DRD1 | P21728 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.34 |
| ▸ | DRD3 | P35462 | 1/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.34 |
| ▸ | KCNA5 | P22460 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8438797 | 0.86 | TAAR1 (0.35) | TP53TAAR1ESR1TSHRALDH1A1 | |
| SCHEMBL20133786 | 0.86 | NPC1 (0.38) | TP53KCNH2SIGMAR1GAAMAPT | |
| SCHEMBL3956329 | 0.82 | TAAR1 (0.39) | TP53TAAR1ESR1TSHRALDH1A1 | |
| SCHEMBL25684761 | 0.82 | TAAR1 (0.39) | TP53TAAR1ESR1TSHRALDH1A1 | |
| SCHEMBL8959902 | 0.81 | TAAR1 (0.49) | TP53TAAR1ESR1TSHRALDH1A1 | |
| SCHEMBL17045962 | 0.80 | TAAR1 (0.38) | TP53TAAR1ESR1TSHRALDH1A1 | |
| SCHEMBL8436010 | 0.80 | TDP1 (0.38) | TP53ESR1ALDH1A1KCNH2OPRM1 | |
| SCHEMBL21049529 | 0.79 | CRHR1 (0.35) | TAAR1SIGMAR1 | |
| SCHEMBL16198577 | 0.78 | ALDH1A1 (0.42) | TP53TSHRALDH1A1GLALMNA | |
| SCHEMBL3954588 | 0.78 | TAAR1 (0.39) | TP53TAAR1ESR1TSHRALDH1A1 |
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-2018089499-A1 | PHENYL AMINO PIPERIDINE mTORC INHIBITORS AND USES THEREOF | NAVITOR PHARMACEUTICALS, INC. (US) | 2018-05-17 | — | — | WO | disclosed |