Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP4F2 | P78329 | 1/20 | 0.56 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.56 |
| ▸ | NPC1 | O15118 | 2/20 | 0.51 |
| ▸ | RAB9A | P51151 | 2/20 | 0.51 |
| ▸ | F10 | P00742 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.46 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.46 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.46 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.46 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.46 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL5256929 | 0.99 | CYP4F2 (0.54) | CYP4F2CYP4A11NPC1RAB9AF10 | |
| SCHEMBL5256925 | 0.88 | NPC1 (0.50) | NPC1RAB9AF10ALDH1A1HPGD | |
| SCHEMBL5256832 | 0.85 | SMN1; SMN2 (0.68) | CYP4F2CYP4A11NPC1RAB9AF10 | |
| SCHEMBL14459994 | 0.85 | CFD (0.55) | NPC1RAB9AF10ALDH1A1HPGD | |
| SCHEMBL9321269 | 0.83 | SMN1; SMN2 (0.67) | SMN1; SMN2HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL5251223 | 0.82 | POLB (0.55) | CYP4F2CYP4A11NPC1RAB9AHSP90AA1 | |
| SCHEMBL5307434 | 0.82 | CYP4F2 (0.55) | CYP4F2CYP4A11NPC1RAB9AF10 | |
| SCHEMBL284798 | 0.81 | SMN1; SMN2 (0.65) | SMN1; SMN2HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL9321159 | 0.81 | SMN1; SMN2 (0.65) | SMN1; SMN2HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL20999952 | 0.81 | SMN1; SMN2 (0.65) | SMN1; SMN2HDAC3HDAC4HDAC1HDAC7 |
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-0765314-A1 | BENZOHETEROCYCLIC DERIVATIVES USEFUL AS VASOPRESSIN OR OXYTOCIN MODULATORS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1997-04-02 | — | — | EP | disclosed |