Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 3/20 | 0.36 |
| ▸ | RAB9A | P51151 | 3/20 | 0.36 |
| ▸ | DHODH | Q02127 | 1/20 | 0.36 |
| ▸ | PTGDR2 | Q9Y5Y4 | 5/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.33 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | GPBAR1 | Q8TDU6 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | F2 | P00734 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9196621 | 1.00 | SMN1; SMN2 (0.38) | SMN1; SMN2KDM4EALDH1A1PKML3MBTL1 | |
| SCHEMBL9550208 | 0.79 | NPC1 (0.62) | L3MBTL1NPC1RAB9AMAPTMEN1 | |
| SCHEMBL9550207 | 0.79 | NPC1 (0.62) | L3MBTL1NPC1RAB9AMAPTMEN1 | |
| SCHEMBL9362075 | 0.78 | KDM4E (0.42) | KDM4EPKMRAB9AMAPTLMNA | |
| SCHEMBL9587765 | 0.78 | KDM4E (0.42) | KDM4EPKMRAB9AMAPTLMNA | |
| SCHEMBL10394271 | 0.78 | DHODH (0.45) | SMN1; SMN2KDM4EALDH1A1PKML3MBTL1 | |
| SCHEMBL10394270 | 0.78 | DHODH (0.45) | SMN1; SMN2KDM4EALDH1A1PKML3MBTL1 | |
| SCHEMBL9550218 | 0.74 | PTGDR2 (0.40) | SMN1; SMN2KDM4EALDH1A1PKML3MBTL1 | |
| SCHEMBL9192255 | 0.73 | ALOX15 (0.34) | KDM4EALDH1A1L3MBTL1NPC1RAB9A | |
| SCHEMBL9191662 | 0.73 | CNR1 (0.45) | SMN1; SMN2L3MBTL1NPC1RAB9AMAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-5196541-A | PROCESS FOR THE PREPARATION OF SUBSTITUTED 3-AMINOACRYLIC ESTERS | BAYER AKTIENGESELLSCHAFT (DE) | 1993-03-23 | — | — | US | disclosed |