Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.34 |
| ▸ | PSMB1 | P20618 | 3/20 | 0.34 |
| ▸ | PSMB5 | P28074 | 3/20 | 0.34 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.33 |
| ▸ | TNF | P01375 | 5/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | CASP7 | P55210 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | KRAS | P01116 | 1/20 | 0.32 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL20786912 | 0.80 | HSD17B10 (0.42) | MAPTGRM2POLBALDH1A1PSMB1 | |
| SCHEMBL22445639 | 0.80 | TNF (0.37) | GRM2POLBPSMB1PSMB5HSP90AB1 | |
| SCHEMBL20809182 | 0.76 | PSMB1 (0.41) | MAPTGRM2POLBALDH1A1PSMB1 | |
| SCHEMBL6923560 | 0.76 | GRM2 (0.55) | GRM2PSMB1PSMB5HSP90AB1TNF | |
| SCHEMBL20808710 | 0.76 | PSMB1 (0.41) | GRM2PSMB1PSMB5HSP90AB1TNF | |
| SCHEMBL20809186 | 0.75 | TNF (0.40) | GRM2POLBPSMB1PSMB5HSP90AB1 | |
| SCHEMBL20809183 | 0.74 | TNF (0.37) | GRM2POLBPSMB1PSMB5HSP90AB1 | |
| SCHEMBL20786901 | 0.73 | TNF (0.41) | GRM2PSMB1PSMB5HSP90AB1TNF | |
| SCHEMBL1725380 | 0.73 | TNF (0.39) | GRM2POLBALDH1A1PSMB1PSMB5 | |
| SCHEMBL20786928 | 0.73 | HDAC3 (0.47) | MAPTGRM2ALDH1A1PSMB1PSMB5 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3941457-A1 | INHIBITORS OF HISTONE DEACETYLASE USEFUL FOR THE TREATMENT OR PREVENTION OF HIV INFECTION | Merck Sharp & Dohme Corp. (US) | 2022-01-26 | — | — | EP | disclosed |
| WO-2020190827-A1 | INHIBITORS OF HISTONE DEACETYLASE USEFUL FOR THE TREATMENT OR PREVENTION OF HIV INFECTION | MERCK SHARP & DOHME CORP. (US) | 2020-09-24 | — | — | WO | disclosed |
| WO-2020190827-A1 | INHIBITORS OF HISTONE DEACETYLASE USEFUL FOR THE TREATMENT OR PREVENTION OF HIV INFECTION | MERCK SHARP & DOHME CORP. (US) | 2020-09-24 | — | — | WO | disclosed |