Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR4A2 | P43354 | 1/20 | 0.43 |
| ▸ | METTL3 | Q86U44 | 1/20 | 0.43 |
| ▸ | NAMPT | P43490 | 4/20 | 0.42 |
| ▸ | WDR5 | P61964 | 3/20 | 0.41 |
| ▸ | NPC1 | O15118 | 3/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | ACACB | O00763 | 2/20 | 0.41 |
| ▸ | ACACA | Q13085 | 2/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | HPGDS | O60760 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | SUV39H2 | Q9H5I1 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8867188 | 0.90 | SUV39H2 (0.44) | METTL3NAMPTNPC1RAB9AKDM4E | |
| SCHEMBL8867134 | 0.89 | SUV39H2 (0.45) | NAMPTWDR5ALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL8866334 | 0.86 | RAB9A (0.45) | NR4A2METTL3WDR5NPC1RAB9A | |
| SCHEMBL8866648 | 0.81 | NR4A2 (0.42) | NR4A2WDR5NPC1RAB9AMAPT | |
| SCHEMBL8866298 | 0.80 | SUV39H2 (0.52) | NAMPTMAPTKDM4EALDH1A1HDAC1 | |
| SCHEMBL8867006 | 0.78 | KDM4E (0.42) | NPC1RAB9AMAPTKDM4EALDH1A1 | |
| SCHEMBL8866814 | 0.78 | ACACB (0.49) | WDR5ACACBACACA | |
| SCHEMBL8867560 | 0.78 | ALDH1A1 (0.48) | METTL3NAMPTNPC1RAB9AMAPT | |
| SCHEMBL8866825 | 0.78 | ALDH1A1 (0.50) | METTL3NAMPTNPC1RAB9AMAPT | |
| SCHEMBL8866714 | 0.77 | ACACB (0.50) | WDR5KDM4EACACBACACAPKM |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5614531-A | Adhesion receptor antagonists | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1997-03-25 | — | — | US | disclosed |
| EP-0668278-A1 | Adhesion receptor antagonists | MERCK PATENT GmbH (DE) | 1995-08-23 | — | — | EP | disclosed |