Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | RECQL | P46063 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 7/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.46 |
| ▸ | LMNA | P02545 | 4/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | ATM | Q13315 | 3/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.43 |
| ▸ | XBP1 | P17861 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL19020192 | 1.00 | HPGD (0.47) | HPGDSMN1; SMN2NPC1RECQLRAB9A | |
| SCHEMBL30850154 | 0.85 | LMNA (0.54) | HPGDSMN1; SMN2NPC1RECQLRAB9A | |
| SCHEMBL29157175 | 0.85 | LMNA (0.54) | HPGDSMN1; SMN2NPC1RECQLRAB9A | |
| SCHEMBL28360448 | 0.85 | LMNA (0.45) | HPGDSMN1; SMN2NPC1RAB9AMEN1 | |
| SCHEMBL29154325 | 0.85 | LMNA (0.45) | HPGDSMN1; SMN2NPC1RAB9AMEN1 | |
| SCHEMBL23345343 | 0.83 | KMT2A (0.58) | SMN1; SMN2NPC1RAB9AMEN1KMT2A | |
| SCHEMBL6060573 | 0.83 | PTGS2 (0.51) | SMN1; SMN2NPC1RECQLRAB9AMEN1 | |
| SCHEMBL1769121 | 0.83 | KMT2A (0.58) | SMN1; SMN2NPC1RAB9AMEN1KMT2A | |
| SCHEMBL28849826 | 0.83 | PTGS2 (0.51) | SMN1; SMN2NPC1RECQLRAB9AMEN1 | |
| SCHEMBL28634821 | 0.83 | CYP1A2 (0.50) | SMN1; SMN2NPC1RAB9AMEN1KMT2A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117736247-A | Preparation method of aryl substituted ferrocene monophosphine ligand containing planar chirality | 南京大学 | 2024-03-22 | — | — | CN | disclosed |
| EP-3394327-A1 | DNA-ENCODED CHEMICAL LIBRARY, USE THEREOF AND METHOD TO SYNTHESIZE THE LIBRARY | Technische Universität Dortmund (DE) | 2018-10-31 | — | — | EP | disclosed |
| WO-2017108741-A1 | DNA-ENCODED CHEMICAL LIBRARY, USE THEREOF AND METHOD TO SYNTHESIZE THE LIBRARY | TECHNISCHE UNIVERSITÄT DORTMUND (DE) | 2017-06-29 | — | — | WO | disclosed |
| EP-3184674-A1 | DNA-ENCODED CHEMICAL LIBRARY, USE THEREOF AND METHOD TO SYNTHESIZE THE LIBRARY | Technische Universität Dortmund (DE) | 2017-06-28 | — | — | EP | disclosed |