Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.36 |
| ▸ | APOBEC3A | P31941 | 2/20 | 0.35 |
| ▸ | APOBEC3G | Q9HC16 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.34 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.34 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.33 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8965936 | 0.87 | TRPA1 (0.38) | TRPA1APOBEC3AAPOBEC3GCYP2D6CHRNB4 | |
| SCHEMBL8965229 | 0.85 | PABPC1 (0.37) | TRPA1APOBEC3AAPOBEC3GCYP2D6CHRNB4 | |
| SCHEMBL8965989 | 0.85 | PABPC1 (0.37) | TRPA1APOBEC3AAPOBEC3GCYP2D6CHRNB4 | |
| SCHEMBL8056810 | 0.80 | CHRNA7 (0.44) | APOBEC3AAPOBEC3GSMN1; SMN2CYP2D6MEN1 | |
| SCHEMBL6122174 | 0.77 | SMN1; SMN2 (0.36) | APOBEC3AAPOBEC3GSMN1; SMN2CYP2D6MEN1 | |
| SCHEMBL8965317 | 0.74 | APOBEC3A (0.36) | APOBEC3AAPOBEC3GSMN1; SMN2CYP2D6MEN1 | |
| SCHEMBL8965744 | 0.74 | ALDH1A1 (0.37) | APOBEC3AAPOBEC3GSMN1; SMN2CYP2D6MEN1 | |
| Water SCHEMBL1702603 | 0.72 | SMN1; SMN2 (0.44) | APOBEC3AAPOBEC3GSMN1; SMN2CYP2D6MEN1 | |
| SCHEMBL8053841 | 0.72 | DNM1 (0.37) | APOBEC3AAPOBEC3GSMN1; SMN2CYP2D6MEN1 | |
| SCHEMBL7723410 | 0.72 | DNM1 (0.37) | APOBEC3AAPOBEC3GSMN1; SMN2CYP2D6MEN1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0619300-B1 | Process for the preparation of halogenmethylbenzoyl cyanides and halogenmethyl benzoylcyanides | BASF AG (DE) | 1996-12-27 | — | — | EP | disclosed |
| US-5510528-A | Preparation of halomethylbenzoly cyanides and novel halomethylbenzoyl cyanides | BASF AKTIENGESELLSCHAFT (DE) | 1996-04-23 | — | — | US | disclosed |
| US-5446199-A | Preparation of halomethylbenzoyl cyanides and novel halomethylbenzoyl cyanides | BASF AKTIENGESELLSCHAFT (DE) | 1995-08-29 | — | — | US | disclosed |
| EP-0619300-A2 | Process for the preparation of halogenmethylbenzoyl cyanides and halogenmethyl benzoylcyanides | BASF Aktiengesellschaft (DE) | 1994-10-12 | — | — | EP | disclosed |