Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | S100A4 | P26447 | 1/20 | 0.38 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA4 | P22748 | 1/20 | 0.35 |
| ▸ | CA7 | P43166 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.35 |
| ▸ | MALT1 | Q9UDY8 | 1/20 | 0.34 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.33 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.33 |
| ▸ | CNR1 | P21554 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 6/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 4/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5328420 | 0.86 | TDP1 (0.41) | TDP1S100A4IDO1ALDH1A1RAB9A | |
| SCHEMBL5328866 | 0.81 | TDP1 (0.42) | TDP1S100A4MALT1IDO1HSD17B10 | |
| SCHEMBL5329038 | 0.79 | TDP1 (0.40) | TDP1S100A4PIK3CGIDO1HSD17B10 | |
| SCHEMBL14386783 | 0.70 | TDP1 (0.49) | TDP1S100A4CA12CA9IDO1 | |
| SCHEMBL5330070 | 0.69 | TDP1 (0.47) | TDP1S100A4IDO1CYP1A2ALDH1A1 | |
| SCHEMBL7898077 | 0.66 | NSD2 (0.40) | TDP1S100A4IDO1CYP1A2CYP3A4 | |
| SCHEMBL11241564 | 0.65 | TDP1 (0.42) | TDP1S100A4CA9IDO1HSD17B10 | |
| SCHEMBL28654605 | 0.62 | TDP1 (0.46) | TDP1S100A4CA12CA4CA7 | |
| SCHEMBL8107 | 0.61 | KDM4E (0.71) | CA12CA4CA7CA9CA14 | |
| SCHEMBL8653625 | 0.61 | RAB9A (0.72) | TDP1S100A4IDO1CYP1A2CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| 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 |
| 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 |