Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 1/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.40 |
| ▸ | BCHE | P06276 | 2/20 | 0.39 |
| ▸ | HRH4 | Q9H3N8 | 4/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 4/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | NOS3 | P29474 | 2/20 | 0.34 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.34 |
| ▸ | BAD | Q92934 | 1/20 | 0.34 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.34 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | HCAR1 | Q9BXC0 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KCNK2 | O95069 | 1/20 | 0.33 |
| ▸ | KCNK10 | P57789 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | KCNK18 | Q7Z418 | 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 | |
|---|---|---|---|---|
| SCHEMBL3397315 | 0.97 | ADORA2A (0.40) | ADORA2AADORA1BCHEHRH4CYP11B2 | |
| SCHEMBL3396520 | 0.81 | ADORA2A (0.36) | ADORA2AADORA1CYP11B2KDM4EALDH1A1 | |
| SCHEMBL3392361 | 0.74 | PARP1 (0.40) | ADORA2AADORA1CYP11B2KDM4EALDH1A1 | |
| SCHEMBL3397543 | 0.72 | NUDT1 (0.54) | ADORA2AADORA1CYP11B2 | |
| SCHEMBL17350713 | 0.72 | CYP2D6 (0.51) | BCHEHRH4KDM4EALDH1A1POLB | |
| SCHEMBL13425393 | 0.71 | CYP11B2 (0.47) | ADORA2AADORA1CYP11B2KDM4EALDH1A1 | |
| SCHEMBL17698887 | 0.71 | BCL2L1 (0.54) | BCHENOS3BCL2L1BADMEN1 | |
| SCHEMBL29488244 | 0.71 | BCL2L1 (0.54) | BCHENOS3BCL2L1BADMEN1 | |
| SCHEMBL13425671 | 0.70 | ATR (0.46) | ADORA2AADORA1KDM4EALDH1A1MEN1 | |
| SCHEMBL1722599 | 0.69 | KDM4E (0.45) | KDM4EALDH1A1POLBNOS3BCL2L1 |
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 |