Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.56 |
| ▸ | ATP4A | P20648 | 1/20 | 0.46 |
| ▸ | ATP4B | P51164 | 1/20 | 0.46 |
| ▸ | CYP1A1 | P04798 | 4/20 | 0.44 |
| ▸ | ITK | Q08881 | 1/20 | 0.42 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.41 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.41 |
| ▸ | HTR2C | P28335 | 1/20 | 0.41 |
| ▸ | METAP1 | P53582 | 1/20 | 0.40 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.40 |
| ▸ | F2RL1 | P55085 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | APEX1 | P27695 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL1799025 | 0.80 | METAP1 (0.50) | MAPTATP4AATP4BITKMETAP1 | |
| SCHEMBL2929240 | 0.76 | CDK5 (0.43) | CDK5CDK5R1METAP1ROCK2SYK | |
| SCHEMBL17680456 | 0.76 | MAPT (0.49) | MAPTATP4AATP4BCYP1A1ITK | |
| SCHEMBL20617946 | 0.73 | ITK (0.48) | ITKMETAP1ROCK2PDPK1 | |
| SCHEMBL8309554 | 0.72 | MAPT (1.00) | MAPTATP4AATP4BCYP1A1ITK | |
| SCHEMBL17674059 | 0.71 | MAPT (0.54) | MAPTATP4AATP4BCYP1A1ITK | |
| SCHEMBL17680426 | 0.71 | MAPT (0.57) | MAPTATP4AATP4BCYP1A1ITK | |
| SCHEMBL4066405 | 0.70 | CYP1A1 (0.55) | MAPTATP4AATP4BCYP1A1ITK | |
| SCHEMBL28704770 | 0.70 | ATP4A (0.46) | MAPTATP4AATP4BCYP1A1ITK | |
| SCHEMBL17674070 | 0.70 | MAPT (0.46) | MAPTATP4AATP4BCYP1A1ITK |
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-2016054807-A1 | TrkA KINASE INHIBITORS, COMPOSITIONS AND METHODS THEREOF | MERCK SHARP & DOHME CORP. (US) | 2016-04-14 | — | — | WO | disclosed |