Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | S100A4 | P26447 | 1/20 | 0.47 |
| ▸ | IDO1 | P14902 | 6/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | HKDC1 | Q2TB90 | 2/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.37 |
| ▸ | HSP90AB1 | P08238 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | APEX1 | P27695 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL14386783 | 0.81 | TDP1 (0.49) | TDP1S100A4IDO1MEN1NPC1 | |
| SCHEMBL11241564 | 0.71 | TDP1 (0.42) | TDP1S100A4IDO1MEN1NPC1 | |
| SCHEMBL7898541 | 0.71 | HSP90AA1 (0.45) | TDP1S100A4IDO1MEN1NPC1 | |
| SCHEMBL20098769 | 0.71 | CDC25A (0.40) | TDP1IDO1CYP1A2CYP2C9APEX1 | |
| SCHEMBL17123733 | 0.71 | MALT1 (0.44) | TDP1IDO1RAB9AHKDC1KDM4E | |
| SCHEMBL8653625 | 0.70 | RAB9A (0.72) | TDP1S100A4IDO1MEN1NPC1 | |
| SCHEMBL5328866 | 0.70 | TDP1 (0.42) | TDP1S100A4IDO1MEN1NPC1 | |
| SCHEMBL5328420 | 0.69 | TDP1 (0.41) | TDP1S100A4IDO1MEN1NPC1 | |
| SCHEMBL28654605 | 0.68 | TDP1 (0.46) | TDP1S100A4IDO1MEN1NPC1 | |
| SCHEMBL5329038 | 0.68 | TDP1 (0.40) | TDP1S100A4IDO1MEN1NPC1 |
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 2 patents. 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 | claimed |
| 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 |