Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 7/20 | 0.49 |
| ▸ | RAB9A | P51151 | 7/20 | 0.49 |
| ▸ | HDAC3 | O15379 | 4/20 | 0.43 |
| ▸ | HDAC4 | P56524 | 3/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.43 |
| ▸ | HDAC7 | Q8WUI4 | 3/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.43 |
| ▸ | HDAC10 | Q969S8 | 3/20 | 0.43 |
| ▸ | HDAC11 | Q96DB2 | 3/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.43 |
| ▸ | HDAC9 | Q9UKV0 | 3/20 | 0.43 |
| ▸ | HDAC5 | Q9UQL6 | 3/20 | 0.43 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.39 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.39 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.38 |
| ▸ | KDM1A | O60341 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29485894 | 0.79 | NPC1 (0.57) | NPC1RAB9AHDAC3HDAC4HDAC1 | |
| SCHEMBL265422 | 0.79 | NPC1 (0.57) | NPC1RAB9AHDAC3HDAC4HDAC1 | |
| SCHEMBL1568799 | 0.73 | NPC1 (0.59) | NPC1RAB9AHDAC3HDAC4HDAC1 | |
| SCHEMBL4648336 | 0.72 | NPC1 (0.50) | NPC1RAB9AHDAC3HDAC4HDAC1 | |
| SCHEMBL5692234 | 0.72 | NPC1 (0.50) | NPC1RAB9AHDAC3HDAC4HDAC1 | |
| SCHEMBL27731439 | 0.72 | MMP1 (0.54) | NPC1RAB9AALDH1A1 | |
| SCHEMBL7410536 | 0.72 | NPC1 (0.57) | NPC1RAB9AHDAC3HDAC4HDAC1 | |
| SCHEMBL1990363 | 0.70 | NPC1 (0.69) | NPC1RAB9AHDAC3EPHX2NCOR2 | |
| SCHEMBL295136 | 0.70 | NPC1 (0.69) | NPC1RAB9AHDAC3EPHX2NCOR2 | |
| SCHEMBL27752014 | 0.69 | SMN1; SMN2 (0.65) | NPC1RAB9AHCAR2ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101365681-B | Iminopropene compound and use thereof | SUMITOMO CHEMICAL CO | 2013-01-02 | — | — | CN | disclosed |
| CN-101365681-A | Iminopropene compound and use thereof | SUMITOMO CHEMICAL CO (JP) | 2009-02-11 | — | — | CN | disclosed |