Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 2/20 | 0.45 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.44 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.42 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.41 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.41 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.41 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.41 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.41 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.41 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.41 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.41 |
| ▸ | BCHE | P06276 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | PKM | P14618 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7714226 | 0.96 | MAOB (0.48) | MAOBCYP4F2CYP4A11CYP2D6MEN1 | |
| SCHEMBL7618088 | 0.89 | SPR (0.42) | ALDH1A1 | |
| SCHEMBL7620391 | 0.87 | CYP2D6 (0.46) | CYP2D6 | |
| SCHEMBL7622109 | 0.85 | MAOB (0.42) | MAOBCYP4F2CYP4A11CYP2D6MEN1 | |
| SCHEMBL7619561 | 0.84 | CYP2D6 (0.40) | MAOBCYP4F2CYP4A11CYP2D6MEN1 | |
| SCHEMBL7614876 | 0.81 | ALDH1A1 (0.46) | ALDH1A1MAPTTHRBRAB9A | |
| SCHEMBL7714053 | 0.81 | CYP2D6 (0.50) | CYP2D6SMPD1 | |
| SCHEMBL7716382 | 0.81 | MAOB (0.46) | MAOBCYP4F2CYP4A11CYP2D6MEN1 | |
| SCHEMBL7622541 | 0.74 | CYP2D6 (0.46) | CYP2D6SMPD1 | |
| Hydrochloric Acid SCHEMBL7622475 | 0.74 | S1PR1 (0.44) | CYP2D6 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1220905-A2 | COMPOSITION AND METHODS FOR THE TREATMENT OF IMMUNE RELATED DISEASES | Genentech Inc. (US) | 2002-07-10 | — | — | EP | disclosed |
| EP-0778263-B1 | BENZENE COMPOUND AND MEDICINAL USE THEREOF | WELFIDE CORP (JP) | 2002-01-09 | — | — | EP | disclosed |
| WO-2000053758-A2 | COMPOSITIONS AND METHODS FOR THE TREATMENT OF IMMUNE RELATED DISEASES | GENENTECH, INC. (US) | 2000-09-14 | — | — | WO | disclosed |