Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.34 |
| ▸ | TP53 | P04637 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | FAAH | O00519 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | CA12 | O43570 | 2/20 | 0.32 |
| ▸ | CA9 | Q16790 | 2/20 | 0.32 |
| ▸ | PIM1 | P11309 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8945107 | 0.86 | FAAH (0.49) | CYP1A2KDM4ETP53HSD17B10FAAH | |
| Hydrochloric Acid SCHEMBL8945306 | 0.86 | FAAH (0.34) | CYP1A2KDM4EFAAHMAPTSMN1; SMN2 | |
| SCHEMBL8945254 | 0.86 | FAAH (0.34) | CYP1A2KDM4EFAAHSMN1; SMN2LMNA | |
| Hydrochloric Acid SCHEMBL8945060 | 0.85 | FAAH (0.48) | CYP1A2KDM4ETP53HSD17B10FAAH | |
| SCHEMBL8945175 | 0.83 | TBK1 (0.33) | CYP1A2KDM4EFAAHSMN1; SMN2LMNA | |
| SCHEMBL8945191 | 0.83 | KCNH2 (0.40) | CYP1A2KDM4EHSD17B10MAPTALDH1A1 | |
| SCHEMBL8944960 | 0.83 | FAAH (0.45) | CYP1A2KDM4ETP53HSD17B10FAAH | |
| Hydrochloric Acid SCHEMBL8945351 | 0.82 | FAAH (0.34) | CYP1A2KDM4EFAAHMAPTSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL8945170 | 0.82 | FAAH (0.38) | CYP1A2KDM4ETP53FAAHTSHR | |
| Hydrochloric Acid SCHEMBL8945261 | 0.82 | FAAH (0.44) | CYP1A2KDM4ETP53HSD17B10FAAH |
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 |
|---|---|---|---|---|---|---|---|
| US-5578627-A | FOR TREATING CEREBRAL CIRCULATORY DISORDER, HEAD INJURY SEQUELAE AND/OR EPILEPSY | TOYAMA CHEMICAL CO., LTD. (JP) | 1996-11-26 | — | — | US | disclosed |
| EP-0665226-A1 | NOVEL 1,2-BENZISOXAZOLE DERIVATIVE OR SALT THEREOF, AND BRAIN PROTECTIVE AGENT COMPRISING THE SAME | TOYAMA CHEMICAL CO., LTD. (JP) | 1995-08-02 | — | — | EP | disclosed |