Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 1/20 | 0.44 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | GAA | P10253 | 3/20 | 0.39 |
| ▸ | HPGD | P15428 | 3/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | CASP3 | P42574 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.39 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.39 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.39 |
| ▸ | AGPAT2 | O15120 | 6/20 | 0.38 |
| ▸ | GRM5 | P41594 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL3395606 | 0.87 | ADORA2A (0.44) | ADORA2AADORA1ALDH1A1TDP1TLR8 | |
| SCHEMBL13425393 | 0.79 | CYP11B2 (0.47) | ADORA2AADORA1ALDH1A1TLR8KDM4E | |
| SCHEMBL2322815 | 0.75 | ADORA2A (0.68) | ADORA2AADORA1ALDH1A1TDP1KDM4E | |
| SCHEMBL3398025 | 0.73 | RAB9A (0.53) | ADORA2AADORA1ALDH1A1HPGDHSD17B10 | |
| SCHEMBL3397543 | 0.73 | NUDT1 (0.54) | ADORA2AADORA1TLR8 | |
| SCHEMBL4282163 | 0.73 | HSP90AA1 (0.54) | KDM4EAGPAT2 | |
| SCHEMBL15757474 | 0.72 | NUDT1 (0.64) | ADORA2ATLR8HSD17B10AGPAT2 | |
| SCHEMBL3398225 | 0.72 | ADORA2A (0.49) | ADORA2AADORA1ALDH1A1TLR8 | |
| SCHEMBL16024366 | 0.71 | CYP2D6 (0.45) | ADORA2AADORA1ALDH1A1TDP1TLR8 | |
| SCHEMBL3391242 | 0.71 | EGLN2 (0.43) | ADORA2AADORA1GRM5 |
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-2010046780-A2 | ANTI VIRAL COMPOUNDS | INSTITUT PASTEUR KOREA (KR) | 2010-04-29 | — | — | WO | disclosed |
| WO-2010046780-A2 | ANTI VIRAL COMPOUNDS | INSTITUT PASTEUR KOREA (KR) | 2010-04-29 | — | — | WO | disclosed |