Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | SCN3A | Q9NY46 | 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 | |
|---|---|---|---|---|
| SCHEMBL5585965 | 0.77 | KDM4E (0.37) | KDM4EHTTSMN1; SMN2TDP1CYP2C19 | |
| SCHEMBL5585874 | 0.67 | POLB (0.32) | TDP1CYP2C19TSHRLMNA | |
| SCHEMBL7717666 | 0.67 | RAB9A (0.37) | KDM4ESMN1; SMN2CYP2C19ALDH1A1LMNA | |
| Biphenyl SCHEMBL3406363 | 0.65 | SMN1; SMN2 (0.62) | KDM4EHTTSMN1; SMN2TDP1CYP2C19 | |
| Cyclopropanecarboxylic Acid Amide SCHEMBL29183025 | 0.63 | KDM4E (0.46) | KDM4EHTTSMN1; SMN2TDP1CYP2C19 | |
| Naphthalene SCHEMBL28572194 | 0.63 | KDM4E (0.47) | KDM4EHTTSMN1; SMN2TDP1CYP2C19 | |
| SCHEMBL9064486 | 0.62 | RAB9A (0.42) | SMN1; SMN2LMNARAB9AGAANPC1 | |
| SCHEMBL3794846 | 0.61 | AKR1C3 (0.61) | KDM4EHTTSMN1; SMN2TDP1CYP2C19 | |
| SCHEMBL16536688 | 0.61 | AKR1C3 (0.61) | KDM4EHTTSMN1; SMN2TDP1CYP2C19 | |
| SCHEMBL1030609 | 0.59 | FAAH (0.44) | KDM4EALDH1A1LMNAGAA |
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-2008074035-A1 | HCV PROTEASE INHIBITORS AND USES THEREOF | ABBOTT LABORATORIES (US) | 2008-06-19 | — | — | WO | disclosed |