Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 6/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.44 |
| ▸ | RAB9A | P51151 | 3/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | ELANE | P08246 | 1/20 | 0.42 |
| ▸ | CTSC | P53634 | 1/20 | 0.42 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.41 |
| ▸ | GSK3B | P49841 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.41 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL5734079 | 0.92 | ALDH1A1 (0.52) | ALDH1A1CYP1A2MEN1KMT2ACYP2C9 | |
| SCHEMBL7432130 | 0.92 | ALDH1A1 (0.52) | ALDH1A1CYP1A2MEN1KMT2ACYP2C9 | |
| SCHEMBL5732981 | 0.92 | ALDH1A1 (0.52) | ALDH1A1CYP1A2MEN1KMT2ACYP2C9 | |
| Hydrochloric Acid SCHEMBL7440042 | 0.91 | ALDH1A1 (0.51) | ALDH1A1CYP1A2MEN1KMT2ACYP2C9 | |
| Hydrochloric Acid SCHEMBL7432117 | 0.91 | ALDH1A1 (0.51) | ALDH1A1CYP1A2MEN1KMT2ACYP2C9 | |
| SCHEMBL18213981 | 0.89 | GSK3B (0.43) | ALDH1A1CYP1A2MEN1KMT2ACYP2C9 | |
| SCHEMBL26370885 | 0.88 | ALDH1A1 (0.51) | ALDH1A1CYP1A2MEN1KMT2ACYP2C9 | |
| SCHEMBL15692785 | 0.84 | MAPT (0.47) | ALDH1A1MEN1KMT2AMAPTRAB9A | |
| SCHEMBL16577350 | 0.84 | NPC1 (0.47) | ALDH1A1CYP1A2MEN1KMT2ACYP2C9 | |
| SCHEMBL18871030 | 0.84 | MAPT (0.47) | ALDH1A1MEN1KMT2AMAPTRAB9A |
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-2012027712-A2 | POTENT AND SELECTIVE INHIBITORS OF HEPATITIS C VIRUS | RFS PHARMA, LLC (US) | 2012-03-01 | — | — | WO | disclosed |