Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | NPC1 | O15118 | 3/20 | 0.37 |
| ▸ | RAB9A | P51151 | 3/20 | 0.37 |
| ▸ | TP53 | P04637 | 2/20 | 0.37 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | ALDH1A2 | O94788 | 1/20 | 0.35 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | LIPG | Q9Y5X9 | 2/20 | 0.33 |
| ▸ | LIPC | P11150 | 1/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 4/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.33 |
| ▸ | HDAC10 | Q969S8 | 3/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8865876 | 0.94 | KDM4E (0.37) | SMN1; SMN2KDM4ENPC1RAB9ATP53 | |
| SCHEMBL8866649 | 0.92 | ALDH1A1 (0.41) | SMN1; SMN2KDM4ENPC1RAB9ATP53 | |
| SCHEMBL8866565 | 0.90 | KDM4E (0.40) | SMN1; SMN2KDM4ENPC1RAB9ATP53 | |
| SCHEMBL8866939 | 0.88 | ALDH1A1 (0.40) | SMN1; SMN2KDM4ENPC1RAB9ATP53 | |
| SCHEMBL8866712 | 0.85 | CYP3A4 (0.46) | SMN1; SMN2KDM4ENPC1RAB9ATP53 | |
| SCHEMBL8866105 | 0.83 | KDM4E (0.40) | SMN1; SMN2KDM4ENPC1RAB9ATP53 | |
| SCHEMBL8866560 | 0.83 | KDM4E (0.41) | SMN1; SMN2KDM4ENPC1RAB9ATP53 | |
| SCHEMBL8866523 | 0.82 | RAB9A (0.43) | SMN1; SMN2KDM4ENPC1RAB9ATP53 | |
| SCHEMBL8866818 | 0.81 | SMN1; SMN2 (0.36) | SMN1; SMN2KDM4ENPC1RAB9ATP53 | |
| SCHEMBL8865866 | 0.79 | CYP3A4 (0.46) | KDM4ENPC1RAB9AHDAC3HDAC1 |
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-5614531-A | Adhesion receptor antagonists | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1997-03-25 | — | — | US | disclosed |