Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | HRAS | P01112 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.38 |
| ▸ | CASP6 | P55212 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | PPID | Q08752 | 1/20 | 0.37 |
| ▸ | DRD4 | P21917 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| Dimethylamine SCHEMBL28814481 | 0.82 | CYP3A4 (0.50) | KDM4ECYP3A4MAPTSMN1; SMN2THRB | |
| SCHEMBL5506614 | 0.82 | KDM4E (0.45) | KDM4ECYP3A4MAPTTHRBTDP1 | |
| SCHEMBL2178103 | 0.82 | CYP3A4 (0.48) | KDM4ECYP3A4MAPTSMN1; SMN2THRB | |
| Water SCHEMBL27527749 | 0.80 | CYP3A4 (0.52) | KDM4ECYP3A4MAPTSMN1; SMN2THRB | |
| Hydrochloric Acid SCHEMBL27547964 | 0.80 | MAPT (0.52) | KDM4ECYP3A4MAPTSMN1; SMN2THRB | |
| SCHEMBL5501337 | 0.79 | ALDH1A1 (0.47) | KDM4ECYP3A4MAPTTDP1LMNA | |
| Chloromethane SCHEMBL27446335 | 0.79 | CYP3A4 (0.45) | KDM4ECYP3A4MAPTSMN1; SMN2THRB | |
| SCHEMBL22472264 | 0.78 | EPHX2 (0.50) | MAPTSMN1; SMN2LMNAMEN1KMT2A | |
| SCHEMBL8369238 | 0.78 | EPHX2 (0.50) | MAPTSMN1; SMN2LMNAMEN1KMT2A | |
| SCHEMBL28504289 | 0.78 | EPHX2 (0.50) | MAPTSMN1; SMN2LMNAMEN1KMT2A |
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-2020023813-A1 | PYRROLO[2,3-B]PYRIDIN DERIVATIVES AS INHIBITORS OF INFLUENZA VIRUS REPLICATION | COCRYSTAL PHARMA, INC. (US) | 2020-01-30 | — | — | WO | disclosed |