Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 4/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.40 |
| ▸ | DHPS | P49366 | 1/20 | 0.39 |
| ▸ | CFTR | P13569 | 1/20 | 0.39 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.39 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | PDE4A | P27815 | 1/20 | 0.39 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.39 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.39 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL20939799 | 0.79 | NPC1 (0.49) | RAB9ANPC1LMNAPOLBTDP1 | |
| SCHEMBL29777621 | 0.78 | CYP2C19 (0.37) | RAB9ANPC1LMNAPOLBTDP1 | |
| SCHEMBL22421130 | 0.77 | MAP3K14 (0.34) | RAB9ANPC1LMNAPOLBTDP1 | |
| SCHEMBL29777585 | 0.75 | POLB (0.38) | RAB9ANPC1LMNAPOLBTDP1 | |
| SCHEMBL22421168 | 0.73 | NPC1 (0.54) | RAB9ANPC1LMNAPOLBTDP1 | |
| SCHEMBL20400203 | 0.73 | NLRP3 (0.38) | LMNAKMT2AALDH1A1MAPK1KDM4E | |
| SCHEMBL11052192 | 0.71 | KMT2A (0.59) | POLBKCNH2GRM2DDB1CRBN | |
| SCHEMBL38653331 | 0.70 | PIN1 (0.46) | POLBALDH1A1PIN1GAA | |
| SCHEMBL7896235 | 0.67 | DHPS (0.46) | RAB9ALMNAPOLBDHPSCFTR | |
| SCHEMBL29777626 | 0.66 | PKM (0.35) | LMNAKMT2AALDH1A1MAPK1SMN1; SMN2 |
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-3478673-B1 | CYANOINDOLINE DERIVATIVES AS NIK INHIBITORS | JANSSEN PHARMACEUTICA NV (BE) | 2020-09-16 | — | — | EP | disclosed |