Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | GLA | P06280 | 1/20 | 0.48 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.42 |
| ▸ | MYC | P01106 | 1/20 | 0.41 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.40 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.40 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.40 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.40 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.40 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.40 |
| ▸ | ACLY | P53396 | 1/20 | 0.40 |
| ▸ | APEX1 | P27695 | 1/20 | 0.39 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.39 |
| ▸ | SRD5A1 | P18405 | 1/20 | 0.39 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CES2 | O00748 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Benzene SCHEMBL28354519 | 0.83 | KDM4E (0.52) | KDM4EGLAAKR1C3MYCNR4A1 | |
| SCHEMBL257347 | 0.81 | KDM4E (0.48) | KDM4EGLAMYCNR4A1MEN1 | |
| SCHEMBL5667262 | 0.80 | ACMSD (0.46) | KDM4EMEN1KMT2ARXFP1CYP1A2 | |
| SCHEMBL26732932 | 0.79 | NR4A2 (0.48) | KDM4EGLACYP1A2CYP2C9HPGD | |
| SCHEMBL1713016 | 0.78 | KDM4E (0.47) | KDM4EMYCSRD5A2CYP1A2 | |
| SCHEMBL689510 | 0.78 | CYP1A2 (0.39) | KDM4EMEN1KMT2ACYP1A2ALOX15 | |
| SCHEMBL8573798 | 0.77 | CSNK2A1 (0.50) | KDM4EAKR1C3MEN1KMT2AACLY | |
| SCHEMBL8576509 | 0.77 | SMN1; SMN2 (0.57) | KDM4EMYCNR4A1MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL3453575 | 0.77 | KDM4E (0.46) | KDM4EMYCSRD5A2CYP1A2 | |
| SCHEMBL4037266 | 0.77 | KDM4E (0.55) | KDM4EGLAMEN1KMT2ARXFP1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1068587-C | Ortho-substituted benzoic acid derivatives | MERCK PATENT GMBH (DE) | 2001-07-18 | — | — | CN | disclosed |
| US-5849796-A | Ortho-substituted benzoil acid derivatives | MERCK PATENT GELSELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1998-12-15 | — | — | US | disclosed |
| CN-1125722-A | Ortho-substituted benzoic acid derivatives | MERCK PATENT GMBH (DE) | 1996-07-03 | — | — | CN | disclosed |