Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | MGLL | Q99685 | 2/20 | 0.41 |
| ▸ | PHGDH | O43175 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | PPP5C | P53041 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | PPP2CA | P67775 | 1/20 | 0.33 |
| ▸ | TFPI2 | P48307 | 1/20 | 0.33 |
| ▸ | NPY4R | P50391 | 1/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL13563361 | 0.85 | CYP1A2 (0.45) | CYP1A2TDP1MGLLPHGDHHTT | |
| SCHEMBL25060325 | 0.81 | ALDH1A1 (0.37) | CYP1A2MGLLPHGDHHTTLMNA | |
| SCHEMBL17214454 | 0.81 | ALDH1A1 (0.37) | CYP1A2MGLLPHGDHHTTLMNA | |
| SCHEMBL16532746 | 0.78 | KMT2A (0.39) | HTTLMNAKDM4EALDH1A1HSD11B1 | |
| SCHEMBL16070171 | 0.77 | HSD11B1 (0.44) | CYP1A2KDM4EALDH1A1HSD11B1 | |
| SCHEMBL25104405 | 0.76 | CHRNB2 (0.42) | PHGDHHSD11B1POLB | |
| SCHEMBL12186331 | 0.75 | CYP1A2 (0.39) | CYP1A2TDP1MGLLPHGDHHTT | |
| SCHEMBL20646668 | 0.74 | MGLL (0.39) | CYP1A2TDP1MGLLPHGDHHTT | |
| SCHEMBL20057365 | 0.74 | MGLL (0.39) | CYP1A2TDP1MGLLPHGDHHTR1A | |
| SCHEMBL23311474 | 0.72 | CYP1A2 (0.41) | CYP1A2TDP1MGLLPHGDHHTT |
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 |
|---|---|---|---|---|---|---|---|
| EP-2797592-B1 | COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY | PTC THERAPEUTICS INC (US) | 2019-08-28 | — | — | EP | disclosed |