Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.43 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | ALB | P02768 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | PCSK7 | Q16549 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | VKORC1 | Q9BQB6 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | SRC | P12931 | 1/20 | 0.41 |
| ▸ | GABBR2 | O75899 | 1/20 | 0.41 |
| ▸ | GABBR1 | Q9UBS5 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL11158835 | 0.85 | MTNR1A (0.42) | ALDH1A1KDM4EMAPTHPGDMTNR1A | |
| SCHEMBL3355942 | 0.83 | CYP2D6 (0.44) | ALDH1A1KDM4EMAPTHPGDCYP2D6 | |
| SCHEMBL1131704 | 0.83 | GABBR2 (0.53) | MAPTCYP2D6SRCGABBR2GABBR1 | |
| Acetamide SCHEMBL27959240 | 0.82 | CYP2C19 (0.47) | ALDH1A1KDM4EMAPTHPGDMTNR1A | |
| SCHEMBL6935978 | 0.82 | STAT3 (0.46) | ALDH1A1HPGDKMT2AMEN1LMNA | |
| SCHEMBL8660435 | 0.82 | POLB (0.42) | ALDH1A1KDM4EMAPTHPGDKMT2A | |
| SCHEMBL4623899 | 0.82 | ESR1 (0.46) | ALDH1A1KDM4EMAPTKMT2ACYP2C9 | |
| SCHEMBL5321358 | 0.82 | BRD4 (0.50) | KMT2ACYP2C9HSD17B10MEN1CYP2D6 | |
| SCHEMBL9491712 | 0.81 | LMNA (0.43) | ALDH1A1KDM4EMAPTHPGDCYP2D6 | |
| SCHEMBL109205 | 0.80 | LMNA (0.53) | ALDH1A1KDM4EMAPTHPGDMTNR1A |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008011074-A2 | HISTONE DEACETYLASE INHIBITORS | ERRANT GENE THERAPEUTICS, LLC (US) | 2008-01-24 | — | — | WO | disclosed |
| EP-1511729-A4 | HISTONE DEACETYLASE INHIBITORS BASED ON ALPHACHALCOGENMETHYLCARBONYL COMPOUNDS | ERRANT GENE THERAPEUTICS LLC (US) | 2006-09-06 | — | — | EP | disclosed |
| EP-1511729-A1 | HISTONE DEACETYLASE INHIBITORS BASED ON ALPHACHALCOGENMETHYLCARBONYL COMPOUNDS | Errant Gene Therapeutics, LLC (US) | 2005-03-09 | — | — | EP | disclosed |
| WO-2003099789-A1 | HISTONE DEACETYLASE INHIBITORS BASED ON ALPHACHALCOGENMETHYLCARBONYL COMPOUNDS | ERRANT GENE THERAPEUTICS, LLC. (US) | 2003-12-04 | — | — | WO | disclosed |
| WO-2001073438-A1 | RICIN INHIBITORS AND METHODS FOR USE THEREOF | RESEARCH DEVELOPMENT FOUNDATION (US) | 2001-10-04 | — | — | WO | disclosed |
| EP-0865426-A1 | AMINO ACID DERIVATIVES, MEDICAMENTS CONTAINING SAID COMPOUNDS AND METHODS OF PRODUCING SAID COMPOUNDS | Dr. Karl Thomae GmbH (DE) | 1998-09-23 | — | — | EP | disclosed |
| WO-1997019914-A1 | AMINO ACID DERIVATIVES, MEDICAMENTS CONTAINING SAID COMPOUNDS AND METHODS OF PRODUCING SAID COMPOUNDS | DR. KARL THOMAE GMBH (DE) | 1997-06-05 | — | — | WO | disclosed |
| EP-0571471-A1 | 5-HETEROYL INDOLE DERIVATIVES. | PFIZER (US) | 1993-12-01 | — | — | EP | disclosed |