Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 1/20 | 0.48 |
| ▸ | IDO1 | P14902 | 1/20 | 0.48 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | MME | P08473 | 1/20 | 0.46 |
| ▸ | USP2 | O75604 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | MC4R | P32245 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.45 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.44 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.44 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL402730 | 0.88 | CYP2D6 (0.47) | THRBIDO1AKR1B1GAAALDH1A1 | |
| SCHEMBL11719114 | 0.83 | ALDH1A1 (0.48) | THRBIDO1GAAUSP2ALDH1A1 | |
| SCHEMBL27770375 | 0.82 | HTT (0.54) | ALDH1A1HPGDKMT2ACYP1A2CYP2C19 | |
| SCHEMBL1792873 | 0.81 | IDO1 (0.60) | THRBIDO1GAAALDH1A1HPGD | |
| SCHEMBL156664 | 0.80 | MEN1 (0.56) | THRBIDO1AKR1B1GAAALDH1A1 | |
| SCHEMBL9074044 | 0.79 | KEAP1 (0.52) | IDO1GAAALDH1A1CYP1A2CYP2D6 | |
| Ammonia Solution, Strong SCHEMBL27486735 | 0.78 | MEN1 (0.54) | THRBIDO1AKR1B1GAAALDH1A1 | |
| Hydrochloric Acid SCHEMBL1252387 | 0.78 | MEN1 (0.54) | THRBIDO1AKR1B1GAAALDH1A1 | |
| Hydrochloric Acid SCHEMBL7340226 | 0.78 | MAPT (0.62) | THRBIDO1GAAALDH1A1HPGD | |
| SCHEMBL24847549 | 0.76 | CYP1A2 (0.54) | THRBIDO1GAAALDH1A1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-101495120-A | Composition for induction or inhibition of stem cell differentiation | CHOONGWAE PHARMA CORP (KR) | 2009-07-29 | — | — | CN | disclosed |
| EP-0899270-B1 | Indolylmethyl-N,N'-bisacylpiperazines as neurokinine receptor antagonists | SOLVAY PHARM GMBH (DE) | 2008-05-21 | — | — | EP | disclosed |