Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | SAE1 | Q9UBE0 | 1/20 | 0.47 |
| ▸ | UBA2 | Q9UBT2 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | IDO1 | P14902 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 2/20 | 0.42 |
| ▸ | MAOA | P21397 | 1/20 | 0.42 |
| ▸ | KCNMA1 | Q12791 | 3/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.40 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL20612886 | 0.81 | ALDH1A1 (0.44) | KDM4EMAPTALDH1A1TSHRCYP1A2 | |
| SCHEMBL19301986 | 0.78 | ALDH1A1 (0.41) | KDM4EHSD17B10MAPTSAE1UBA2 | |
| SCHEMBL3208371 | 0.77 | MAPT (0.52) | KDM4EHSD17B10MAPTSAE1UBA2 | |
| SCHEMBL27782173 | 0.77 | MAPT (0.52) | KDM4EMAPTALDH1A1TSHRCYP1A2 | |
| SCHEMBL9826464 | 0.75 | ALDH1A1 (0.46) | KDM4EMAPTALDH1A1TSHRCYP1A2 | |
| SCHEMBL5409015 | 0.75 | ALDH1A1 (0.59) | KDM4EHSD17B10MAPTALDH1A1TSHR | |
| Acetic Acid SCHEMBL5042428 | 0.74 | HTT (0.47) | KDM4EMAPTALDH1A1TSHRSLC22A6 | |
| SCHEMBL14795733 | 0.73 | CYP3A4 (0.53) | MAPTTSHRSLC22A6SLC22A8MEN1 | |
| SCHEMBL10638316 | 0.72 | ALDH1A1 (0.46) | KDM4EHSD17B10MAPTALDH1A1TSHR | |
| SCHEMBL7500143 | 0.72 | KDM4E (0.53) | KDM4EHSD17B10MAPTALDH1A1CYP1A2 |
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-2007134328-A2 | GELDANAMYCINS AND THEIR QUINONE MOIETIES INHIBIT CANCER BY ACTING ON MITOCHONDRIAL VOLTAGE-DEPENDENT ANION CHANNEL (VDAC) PROTEIN | VAN ANDEL RESEARCH INSTITUTE (US) | 2007-11-22 | — | — | WO | disclosed |