Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | APOBEC3A | P31941 | 2/20 | 0.34 |
| ▸ | APOBEC3G | Q9HC16 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | CTSS | P25774 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.32 |
| ▸ | PRSS2 | P07478 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8059280 | 0.88 | ALDH1A1 (0.38) | ALDH1A1KDM4ECA2CYP3A4MEN1 | |
| SCHEMBL20657998 | 0.82 | ALDH1A1 (0.44) | ALDH1A1KDM4ECA2CYP3A4MEN1 | |
| SCHEMBL21694862 | 0.81 | ALDH1A1 (0.42) | ALDH1A1CA2CYP3A4MEN1KMT2A | |
| SCHEMBL8965317 | 0.80 | APOBEC3A (0.36) | ALDH1A1MEN1KMT2AAPOBEC3AAPOBEC3G | |
| SCHEMBL7723410 | 0.77 | DNM1 (0.37) | MEN1KMT2AAPOBEC3AAPOBEC3GCYP2D6 | |
| SCHEMBL8053841 | 0.77 | DNM1 (0.37) | MEN1KMT2AAPOBEC3AAPOBEC3GCYP2D6 | |
| SCHEMBL6122174 | 0.76 | SMN1; SMN2 (0.36) | ALDH1A1KDM4EMEN1KMT2ANPC1 | |
| Bromide SCHEMBL9784512 | 0.76 | DNM1 (0.39) | ALDH1A1MEN1KMT2AAPOBEC3AAPOBEC3G | |
| Ammonia Solution, Strong SCHEMBL8092892 | 0.76 | DNM1 (0.36) | MEN1KMT2AAPOBEC3AAPOBEC3GCYP2D6 | |
| Hydrochloric Acid SCHEMBL6939665 | 0.76 | MEN1 (0.39) | MEN1KMT2AAPOBEC3AAPOBEC3GCYP2D6 |
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 |