Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRAF | P15056 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | ERN1 | O75460 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.40 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.40 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.40 |
| ▸ | NCOA1 | Q15788 | 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 | |
|---|---|---|---|---|
| SCHEMBL358711 | 0.88 | ALDH1A1 (0.47) | BRAFALDH1A1KDM4ESMN1; SMN2MEN1 | |
| SCHEMBL4628094 | 0.81 | ALDH1A1 (0.57) | BRAFALDH1A1KDM4ESLC6A3SLC6A4 | |
| SCHEMBL9754355 | 0.78 | ALDH1A1 (0.40) | BRAFALDH1A1KDM4ESMN1; SMN2MEN1 | |
| SCHEMBL16959260 | 0.77 | SMN1; SMN2 (0.48) | BRAFALDH1A1KDM4ESMN1; SMN2MEN1 | |
| SCHEMBL9099491 | 0.77 | ERN1 (0.47) | ALDH1A1KDM4ESMN1; SMN2MEN1KMT2A | |
| SCHEMBL4657747 | 0.77 | ALDH1A1 (0.45) | BRAFALDH1A1KDM4EMEN1KMT2A | |
| SCHEMBL8421994 | 0.76 | ALDH1A1 (0.55) | ALDH1A1KDM4ESMN1; SMN2MEN1KMT2A | |
| SCHEMBL6655751 | 0.76 | SMN1; SMN2 (0.47) | BRAFALDH1A1KDM4ESLC6A3SLC6A4 | |
| SCHEMBL13982727 | 0.76 | MAPT (0.60) | BRAFALDH1A1KDM4ESLC6A3SLC6A4 | |
| SCHEMBL29410907 | 0.75 | SLC6A3 (0.50) | BRAFALDH1A1SLC6A3SLC6A4SMN1; SMN2 |
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-2015051766-A1 | AMIDS SUBSTITUTED INDAZOLE DERIVATIVEES AS PLOY (ADP-RIBOSE) POLYMERASE INHIBITORS | BETTA PHARMACEUTICALS CO., LTD (CN) | 2015-04-16 | — | — | WO | disclosed |