Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | SYK | P43405 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.41 |
| ▸ | JAK2 | O60674 | 1/20 | 0.41 |
| ▸ | JAK3 | P52333 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | CDK1 | P06493 | 1/20 | 0.39 |
| ▸ | CDK4 | P11802 | 1/20 | 0.39 |
| ▸ | CCND1 | P24385 | 1/20 | 0.39 |
| ▸ | CDK2 | P24941 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL2465997 | 0.84 | SYK (0.43) | PARP1MEN1KMT2ASYKNPSR1 | |
| SCHEMBL17786110 | 0.82 | PARP1 (0.44) | PARP1MEN1KMT2ASYKNPSR1 | |
| SCHEMBL28020430 | 0.78 | PARP1 (0.40) | PARP1MEN1KMT2AMAPTTP53 | |
| SCHEMBL4560309 | 0.78 | PARP1 (0.58) | PARP1PARP2 | |
| SCHEMBL17786116 | 0.77 | ALDH1A1 (0.44) | PARP1MEN1KMT2ALMNATSHR | |
| SCHEMBL7226255 | 0.77 | PARP1 (0.43) | PARP1MEN1KMT2AMAPTPARP2 | |
| Hydrochloric Acid SCHEMBL27632601 | 0.76 | PARP1 (0.42) | PARP1MEN1KMT2AMAPTPARP2 | |
| SCHEMBL26606681 | 0.76 | HTT (0.39) | MEN1KMT2ANPSR1MAPTLMNA | |
| SCHEMBL28307571 | 0.73 | IDO1 (0.42) | MEN1KMT2ANPSR1MAPTLMNA | |
| SCHEMBL17786120 | 0.72 | CRBN (0.34) | PARP1MAPTTSHRALDH1A1 |
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-2016086153-A2 | USE OF TETRAHYDRO!NDAZOLYLBEIMZAMIDE AND TETRAHYDROINDOLYLBENZAMIDE DERIVATIVES FOR THE TREATMENT OF HUMAN IMMUNODEFICIENCY VIRUS (HIV) AND ACQUIRED IMMUNE DEFICIENCY SYNDROME (AIDS) | ESANEX, INC. (US) | 2016-06-02 | — | — | WO | disclosed |