Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 2/20 | 0.43 |
| ▸ | MAOB | P27338 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | KMO | O15229 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | METAP2 | P50579 | 1/20 | 0.34 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.34 |
| ▸ | FYN | P06241 | 1/20 | 0.34 |
| ▸ | DRD4 | P21917 | 1/20 | 0.33 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.33 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.33 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL21937073 | 0.85 | KDM1A (0.43) | KDM1AMAOBNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL16905496 | 0.84 | HSD17B1 (0.33) | KDM1AMAOB | |
| SCHEMBL21937074 | 0.84 | NPC1 (0.39) | NPC1RAB9ASMN1; SMN2CHRNB2CHRNA4 | |
| SCHEMBL16905136 | 0.79 | ALOX5AP (0.32) | — | |
| SCHEMBL21938123 | 0.79 | KDM1A (0.39) | KDM1AMAOBNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL16905240 | 0.75 | RARA (0.32) | — | |
| SCHEMBL16905459 | 0.75 | — | — | |
| SCHEMBL21937077 | 0.74 | FLT3 (0.35) | CHRNB2CHRNA4 | |
| SCHEMBL19561492 | 0.73 | — | — | |
| SCHEMBL16905208 | 0.72 | KDM1A (0.38) | KDM1AMAOBBRD4 |
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-2020064662-A2 | METHOD FOR PRODUCING STERICALLY HINDERED, NITROGEN-CONTAINING HETEROAROMATIC COMPOUNDS | MERCK PATENT GMBH (DE) | 2020-04-02 | — | — | WO | disclosed |