Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 3/20 | 0.34 |
| ▸ | KDR | P35968 | 1/20 | 0.34 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.34 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.34 |
| ▸ | BCHE | P06276 | 1/20 | 0.32 |
| ▸ | CES1 | P23141 | 1/20 | 0.32 |
| ▸ | PNMT | P11086 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL20918382 | 0.80 | ALDH1A1 (0.35) | ALDH1A1KDM4ENPC1MAPTRAB9A | |
| SCHEMBL216860 | 0.74 | ALDH1A1 (0.38) | ALDH1A1KDM4ENPC1MAPTRAB9A | |
| SCHEMBL2051734 | 0.72 | CYP1A2 (0.38) | ALDH1A1KDM4ENPC1MAPTRAB9A | |
| SCHEMBL1539776 | 0.71 | ALDH1A1 (0.36) | ALDH1A1KDM4ENPC1MAPTRAB9A | |
| SCHEMBL23087114 | 0.70 | KDR (0.39) | ALDH1A1KDM4ENPC1MAPTRAB9A | |
| Fluorene SCHEMBL473154 | 0.70 | MAOA (0.56) | ALDH1A1KDM4ENPC1MAPTRAB9A | |
| Fluorene SCHEMBL27273010 | 0.68 | MAOA (0.54) | ALDH1A1KDM4ENPC1MAPTRAB9A | |
| SCHEMBL6003336 | 0.68 | KDR (0.36) | MAOAKDRADORA2AADORA1BCHE | |
| Fluorene SCHEMBL9079589 | 0.67 | ALDH1A1 (0.50) | ALDH1A1KDM4ENPC1MAPTRAB9A | |
| Fluorene SCHEMBL14118022 | 0.67 | MAOA (0.65) | ALDH1A1KDM4ENPC1MAPTRAB9A |
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-2019078443-A1 | NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME | 주식회사 엘지화학 | 2019-04-25 | — | — | WO | disclosed |