Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TGM2 | P21980 | 2/20 | 0.47 |
| ▸ | THRB | P10828 | 2/20 | 0.47 |
| ▸ | THRA | P10827 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | F13A1 | P00488 | 1/20 | 0.40 |
| ▸ | TGM1 | P22735 | 1/20 | 0.40 |
| ▸ | TGM3 | Q08188 | 1/20 | 0.40 |
| ▸ | LSS | P48449 | 2/20 | 0.38 |
| ▸ | PYCR1 | P32322 | 1/20 | 0.38 |
| ▸ | MME | P08473 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.35 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.35 |
| ▸ | BLM | P54132 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3136867 | 0.91 | THRB (0.55) | TGM2THRBTHRACYP2C19ALDH1A1 | |
| SCHEMBL8161806 | 0.83 | THRA (0.47) | THRBTHRACYP2C19ALDH1A1CYP3A4 | |
| SCHEMBL16740573 | 0.83 | THRA (0.47) | TGM2THRBTHRACYP2C19ALDH1A1 | |
| SCHEMBL11092024 | 0.82 | CYP3A4 (0.58) | THRBTHRACYP2C19ALDH1A1CYP3A4 | |
| SCHEMBL9422511 | 0.81 | THRB (0.54) | THRBTHRACYP2C19ALDH1A1CYP3A4 | |
| SCHEMBL16740537 | 0.80 | ALDH1A1 (0.47) | TGM2THRBTHRAALDH1A1CYP3A4 | |
| SCHEMBL5149405 | 0.78 | BLM (0.46) | ALDH1A1CYP3A4LMNAMMEMEN1 | |
| SCHEMBL10767808 | 0.78 | LMNA (0.42) | TGM2THRBTHRACYP2C19ALDH1A1 | |
| SCHEMBL16740667 | 0.78 | TGM2 (0.45) | TGM2THRBTHRACYP2C19ALDH1A1 | |
| SCHEMBL3664414 | 0.76 | HTT (0.38) | THRBTHRACYP2C19CYP3A4POLB |
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-2015075051-A1 | ALLOSTERIC INHIBITORS OF ATYPICAL PROTEIN KINASES C | UNIVERSITAET DES SAARLANDES (DE) | 2015-05-28 | — | — | WO | disclosed |