Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IGF1R | P08069 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | DDB1 | Q16531 | 2/20 | 0.35 |
| ▸ | CRBN | Q96SW2 | 2/20 | 0.35 |
| ▸ | DRD1 | P21728 | 5/20 | 0.34 |
| ▸ | ESR1 | P03372 | 2/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.34 |
| ▸ | DRD2 | P14416 | 2/20 | 0.34 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.34 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.34 |
| ▸ | GID4 | Q8IVV7 | 1/20 | 0.33 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Ammonia Solution, Strong SCHEMBL6216585 | 0.78 | IGF1R (0.50) | IGF1RALOX15CYP11B1GID4CYP17A1 | |
| SCHEMBL11213350 | 0.77 | ESR2 (0.54) | DRD1ESR1ESR2DRD2CYP11B1 | |
| SCHEMBL24684598 | 0.73 | DRD1 (0.50) | IGF1RALOX15DDB1CRBNDRD1 | |
| SCHEMBL15679221 | 0.73 | KDM1A (0.48) | HTR2A | |
| SCHEMBL10923648 | 0.72 | ALDH1A1 (0.46) | IGF1RALOX15TSHR | |
| SCHEMBL24684584 | 0.68 | DRD1 (0.49) | IGF1RALOX15DDB1CRBNDRD1 | |
| SCHEMBL5709402 | 0.68 | CYP17A1 (0.46) | CYP11B1CYP17A1CYP3A4CYP11B2HTR2A | |
| SCHEMBL8938850 | 0.68 | IGF1R (0.61) | IGF1RALOX15DRD1DRD2CYP3A4 | |
| SCHEMBL9409776 | 0.67 | DRD1 (0.45) | DRD1ESR1ESR2DRD2CYP11B1 | |
| SCHEMBL17748868 | 0.67 | IGF1R (0.47) | IGF1RALOX15DRD1DRD2CYP19A1 |
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-101282960-A | RAF inhibitor compounds and methods | GENENTECH INC (US) | 2008-10-08 | — | — | CN | disclosed |
| CN-1281433-A | Hydroxamic acid derivatives as matrix metalloproteinase (MMP) inhibitors | PFIZER LTD (US) | 2001-01-24 | — | — | CN | disclosed |