Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACKR3 | P25106 | 1/20 | 0.47 |
| ▸ | GLS | O94925 | 2/20 | 0.42 |
| ▸ | BACE1 | P56817 | 2/20 | 0.41 |
| ▸ | CTSD | P07339 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | KDM1A | O60341 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | HTR6 | P50406 | 4/20 | 0.37 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.37 |
| ▸ | BCHE | P06276 | 2/20 | 0.37 |
| ▸ | FPR3 | P25089 | 1/20 | 0.37 |
| ▸ | FPR2 | P25090 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | NAMPT | P43490 | 1/20 | 0.37 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.36 |
| ▸ | FAAH | O00519 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL14923304 | 0.81 | KDM5A (0.44) | KMT2AEPHX1KDM4EHPGD | |
| SCHEMBL23747111 | 0.77 | ACKR3 (0.57) | ACKR3GLSBACE1CTSDMEN1 | |
| SCHEMBL17207589 | 0.75 | ACKR3 (0.57) | ACKR3GLSBACE1CTSDMEN1 | |
| SCHEMBL4013908 | 0.75 | ACKR3 (0.60) | ACKR3GLSMEN1ALDH1A1MAPT | |
| SCHEMBL3002618 | 0.75 | ACKR3 (0.57) | ACKR3GLSBACE1CTSDMEN1 | |
| SCHEMBL4014855 | 0.75 | ACKR3 (0.60) | ACKR3GLSMEN1ALDH1A1MAPT | |
| SCHEMBL3002627 | 0.75 | ACKR3 (0.57) | ACKR3GLSBACE1CTSDMEN1 | |
| SCHEMBL4013905 | 0.75 | ACKR3 (0.60) | ACKR3GLSMEN1ALDH1A1MAPT | |
| SCHEMBL31747257 | 0.74 | MEN1 (0.49) | ACKR3GLSBACE1CTSDMEN1 | |
| SCHEMBL28626485 | 0.74 | MEN1 (0.49) | ACKR3GLSBACE1CTSDMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1699455-B1 | HETEROCYCLIC ASPARTYL PROTEASE INHIBITORS | MERCK SHARP & DOHME (US) | 2013-05-08 | — | — | EP | disclosed |