Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.53 |
| ▸ | S100B | P04271 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.50 |
| ▸ | SCN1A | P35498 | 1/20 | 0.50 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.50 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.50 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.50 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.50 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.50 |
| ▸ | RAD52 | P43351 | 1/20 | 0.49 |
| ▸ | BCHE | P06276 | 2/20 | 0.49 |
| ▸ | ACHE | P22303 | 2/20 | 0.49 |
| ▸ | TLR8 | Q9NR97 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL12850059 | 0.94 | S100B (0.50) | CYP1A2S100BCYP2C9CYP2C19TSHR | |
| SCHEMBL8943305 | 0.88 | S100B (0.50) | CYP1A2S100BCYP2C9CYP2C19TSHR | |
| SCHEMBL8928198 | 0.86 | S100B (0.51) | CYP1A2S100BCYP2C9CYP2C19TSHR | |
| SCHEMBL10953026 | 0.85 | ALDH1A1 (0.59) | S100BTSHRHIF1ATLR8ALDH1A1 | |
| SCHEMBL12283447 | 0.83 | TLR8 (0.48) | CYP1A2S100BCYP2C9CYP2C19TSHR | |
| SCHEMBL8014237 | 0.80 | S100B (0.59) | S100BTSHRALDH1A1L3MBTL1MAPK1 | |
| SCHEMBL11315881 | 0.79 | ALDH1A1 (0.43) | CYP1A2S100BCYP2C9CYP2C19TSHR | |
| SCHEMBL9073465 | 0.78 | ALDH1A1 (0.69) | CYP1A2CYP2C9CYP2C19TSHRCYP2D6 | |
| SCHEMBL8397383 | 0.78 | CYP1A2 (0.61) | CYP1A2CYP2C9CYP2C19TSHRCYP2D6 | |
| SCHEMBL11416116 | 0.78 | CYP1A2 (0.61) | CYP1A2CYP2C9CYP2C19TSHRCYP2D6 |
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-4332884-A | USING A DIOXIME CHELATING AGENT | RICOH CO., LTD. (JP) | 1982-06-01 | — | — | US | disclosed |
| US-4306014-A | AMMONIA OR AMINES SUPPRESS THE COLOR-FORMING REACTION SYSTEM | RICOH CO., LTD. (JP) | 1981-12-15 | — | — | US | disclosed |