Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 1/20 | 0.63 |
| ▸ | GSK3A | P49840 | 1/20 | 0.56 |
| ▸ | GSK3B | P49841 | 1/20 | 0.56 |
| ▸ | RAB9A | P51151 | 7/20 | 0.55 |
| ▸ | NPC1 | O15118 | 5/20 | 0.55 |
| ▸ | MEN1 | O00255 | 2/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.54 |
| ▸ | POLB | P06746 | 2/20 | 0.53 |
| ▸ | MDM4 | O15151 | 1/20 | 0.53 |
| ▸ | TP53 | P04637 | 1/20 | 0.53 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.53 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.53 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.53 |
| ▸ | HPGD | P15428 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL27990883 | 0.81 | KDR (0.65) | KDRRAB9ANPC1POLBMDM4 | |
| SCHEMBL27578898 | 0.81 | KDR (0.65) | KDRRAB9ANPC1KMT2APOLB | |
| SCHEMBL30117873 | 0.80 | RAB9A (0.79) | KDRRAB9ANPC1MEN1KMT2A | |
| SCHEMBL27874235 | 0.80 | KDR (0.63) | KDRRAB9ANPC1MEN1KMT2A | |
| SCHEMBL2771907 | 0.80 | HDAC1 (0.67) | KDRGSK3BRAB9ANPC1POLB | |
| SCHEMBL3096372 | 0.80 | RAB9A (0.79) | KDRRAB9ANPC1MEN1KMT2A | |
| SCHEMBL1110180 | 0.78 | MDM4 (0.73) | RAB9ANPC1MEN1KMT2APOLB | |
| SCHEMBL29434873 | 0.78 | KDR (1.00) | KDRRAB9ANPC1MEN1KMT2A | |
| SCHEMBL6260903 | 0.78 | KDR (1.00) | KDRRAB9ANPC1MEN1KMT2A | |
| SCHEMBL2081672 | 0.78 | KDR (0.60) | KDRRAB9ANPC1KMT2APOLB |
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-2012100223-A1 | SYNTHETIC LETHAL TARGETING OF GLUCOSE TRANSPORT | IRWIN JOHN (US) | 2012-07-26 | — | — | WO | disclosed |