Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | NR1H3 | Q13133 | 4/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
| ▸ | NR1H2 | P55055 | 3/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | ADK | P55263 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | PGR | P06401 | 1/20 | 0.31 |
| ▸ | DPP4 | P27487 | 1/20 | 0.31 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL20933407 | 0.95 | USP2 (0.32) | NPC1RAB9AMEN1KMT2ACYP1A2 | |
| SCHEMBL20933125 | 0.95 | USP2 (0.32) | NPC1RAB9AMEN1KMT2ACYP1A2 | |
| SCHEMBL20933418 | 0.94 | USP2 (0.32) | NPC1RAB9AMEN1KMT2ACYP1A2 | |
| SCHEMBL20933419 | 0.94 | USP2 (0.32) | NPC1RAB9AMEN1KMT2ACYP1A2 | |
| SCHEMBL20933117 | 0.94 | USP2 (0.32) | NPC1RAB9AMEN1KMT2ACYP1A2 | |
| SCHEMBL20933151 | 0.94 | USP2 (0.32) | NPC1RAB9AMEN1KMT2ACYP1A2 | |
| SCHEMBL20933982 | 0.91 | ADORA2A (0.32) | NPC1RAB9AMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL20934090 | 0.91 | ADORA2A (0.32) | NPC1RAB9AMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL20934117 | 0.91 | ADORA2A (0.32) | NPC1RAB9AMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL20933976 | 0.91 | ADORA2A (0.32) | NPC1RAB9AMEN1KMT2ASMN1; SMN2 |
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-2019078461-A1 | NOVEL HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME | 주식회사 엘지화학 | 2019-04-25 | — | — | WO | disclosed |