Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.36 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | MYC | P01106 | 1/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.34 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.34 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.34 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.34 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.34 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.34 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.34 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.34 |
| ▸ | GALR1 | P47211 | 1/20 | 0.33 |
| ▸ | CDK1 | P06493 | 1/20 | 0.33 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.33 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.33 |
| ▸ | CDK2 | P24941 | 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 | |
|---|---|---|---|---|
| SCHEMBL8963295 | 0.89 | NPC1 (0.37) | NPC1RAB9ASIGMAR1GRIN2DGRIN3B | |
| SCHEMBL18486592 | 0.82 | NPC1 (0.46) | NPC1RAB9ASIGMAR1EPHX1MEN1 | |
| SCHEMBL5569714 | 0.76 | MEN1 (0.38) | NPC1RAB9AMEN1KMT2A | |
| SCHEMBL9797034 | 0.76 | DDB1 (0.34) | NPC1RAB9ADDB1CRBNHDAC1 | |
| SCHEMBL1691086 | 0.74 | HTR7 (0.41) | NPC1RAB9AMEN1KMT2A | |
| SCHEMBL30318774 | 0.74 | HTR7 (0.41) | NPC1RAB9AMEN1KMT2A | |
| SCHEMBL30008143 | 0.74 | ALDH1A1 (0.42) | NPC1RAB9AMEN1KMT2A | |
| SCHEMBL24782558 | 0.73 | NPC1 (0.39) | NPC1RAB9ADDB1CRBNEPHX1 | |
| SCHEMBL1574869 | 0.73 | ALDH1A1 (0.45) | MEN1KMT2A | |
| SCHEMBL3883821 | 0.73 | MYC (0.44) | NPC1RAB9AMYCCA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0583433-B1 | DIPHOSPHINE LIGANDS | HOFFMANN LA ROCHE (CH) | 1999-05-12 | — | — | EP | disclosed |
| EP-0579797-B1 | DIPHOSPHINE LIGANDS | HOFFMANN LA ROCHE (CH) | 1999-04-21 | — | — | EP | disclosed |