Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 2/20 | 0.40 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.40 |
| ▸ | AVPR2 | P30518 | 1/20 | 0.39 |
| ▸ | AVPR1A | P37288 | 1/20 | 0.39 |
| ▸ | NR1I3 | Q14994 | 3/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | LIPE | Q05469 | 1/20 | 0.38 |
| ▸ | NAMPT | P43490 | 1/20 | 0.38 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.37 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | BACE1 | P56817 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL16239010 | 0.73 | P2RX4 (0.49) | BRD4CREBBPNR1I3DRD2LIPE | |
| SCHEMBL14525364 | 0.71 | SMN1; SMN2 (0.53) | DRD2ALDH1A1MAPTNPC1RAB9A | |
| SCHEMBL6503210 | 0.69 | MAPT (0.50) | NAMPTCD274ALDH1A1MAPTKDM4E | |
| SCHEMBL13055402 | 0.67 | CYP17A1 (0.59) | DRD2LIPENAMPTCYP17A1ALDH1A1 | |
| SCHEMBL27292734 | 0.67 | NAMPT (0.49) | DRD2LIPENAMPTALDH1A1MAPT | |
| SCHEMBL1968536 | 0.66 | DDB1 (0.45) | BRD4CREBBPNR1I3NAMPTCYP17A1 | |
| SCHEMBL8346062 | 0.65 | PRKDC (0.63) | CD274ALDH1A1MAPTKDM4ENPC1 | |
| SCHEMBL993933 | 0.65 | GAA (0.64) | DRD2NAMPTMAPTNPC1RAB9A | |
| SCHEMBL8739188 | 0.65 | MAPT (0.58) | ALDH1A1MAPTKDM4ENPC1RAB9A | |
| SCHEMBL28392058 | 0.65 | BRD4 (0.45) | BRD4NAMPTCYP17A1CA12CA1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-108863959-B | P2X4 receptor antagonists | 日本化学药品株式会社 | 2021-11-30 | — | — | CN | disclosed |
| CN-111333588-A | P2X4 receptor antagonists | 日本化学药品株式会社 | 2020-06-26 | — | — | CN | disclosed |