Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | IDO1 | P14902 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.35 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.35 |
| ▸ | PTGER3 | P43115 | 1/20 | 0.35 |
| ▸ | PTGER2 | P43116 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | HTR2C | P28335 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6471673 | 0.81 | CYP1A2 (0.54) | TAAR1CYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL30403428 | 0.81 | KEAP1 (0.54) | TAAR1CYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL4336097 | 0.81 | KEAP1 (0.54) | TAAR1CYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL6472113 | 0.80 | CYP1A2 (0.46) | TAAR1CYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL1137802 | 0.80 | AKR1B1 (0.52) | TAAR1AKR1B1 | |
| SCHEMBL28088495 | 0.79 | TAAR1 (0.54) | TAAR1CYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL1921001 | 0.79 | PLAAT3 (0.50) | TAAR1ALDH1A1 | |
| SCHEMBL1920462 | 0.79 | CTBP2 (0.47) | TAAR1ALDH1A1LMNAPOLBMAPT | |
| SCHEMBL17975816 | 0.79 | FFAR1 (0.48) | ALDH1A1LMNAMAPTMAPK1HTT | |
| SCHEMBL11393612 | 0.79 | FDPS (0.38) | ALDH1A1LMNAUSP2POLBMAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005109041-A1 | COMPOSITIONS FOR USE IN THE MANUFACTURE OF LENSES | MEDICAL POLYMERS LIMITED (GB) | 2005-11-17 | — | — | WO | claimed |
| WO-2005109041-A1 | COMPOSITIONS FOR USE IN THE MANUFACTURE OF LENSES | MEDICAL POLYMERS LIMITED (GB) | 2005-11-17 | — | — | WO | disclosed |