Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 2/20 | 0.54 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.50 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.50 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.50 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.50 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 5/20 | 0.48 |
| ▸ | TP53 | P04637 | 4/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.48 |
| ▸ | RAB9A | P51151 | 2/20 | 0.48 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.47 |
| ▸ | HPSE | Q9Y251 | 1/20 | 0.45 |
| ▸ | AGPAT2 | O15120 | 2/20 | 0.45 |
| ▸ | UTRN | P46939 | 1/20 | 0.44 |
| ▸ | C1R | P00736 | 1/20 | 0.44 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.43 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.43 |
| ▸ | ELANE | P08246 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| Methane SCHEMBL11178455 | 0.88 | HDAC3 (0.53) | KDRHDAC3HDAC1HDAC2HDAC8 | |
| SCHEMBL14591804 | 0.87 | KDR (0.52) | KDRHDAC3HDAC1HDAC2HDAC8 | |
| SCHEMBL14626708 | 0.86 | TP53 (0.53) | KDRMAPTTP53SMN1; SMN2NPC1 | |
| SCHEMBL14627052 | 0.85 | ATM (0.44) | KDRMAPTTP53SMN1; SMN2NPC1 | |
| SCHEMBL14626711 | 0.82 | CASP3 (0.61) | KDRMAPTSMN1; SMN2NPC1RAB9A | |
| SCHEMBL14627049 | 0.78 | ITGB1 (0.55) | SMN1; SMN2NPC1RAB9APDCD1CD274 | |
| SCHEMBL16972929 | 0.76 | HSD17B10 (0.60) | KDRHDAC3HDAC1HDAC2HDAC8 | |
| SCHEMBL11178446 | 0.75 | MAOA (0.55) | KDRHDAC3HDAC1HDAC2HDAC8 | |
| SCHEMBL14626645 | 0.75 | KDM4E (0.66) | HDAC6MAPTTP53SMN1; SMN2NPC1 | |
| SCHEMBL14591807 | 0.74 | TP53 (0.50) | KDRMAPTTP53SMN1; SMN2NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7157487-B2 | Vla-4 inhibitors | DAIICHI PHARMACEUTICAL CO., LTD. (JP) | 2007-01-02 | — | — | US | disclosed |