Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.38 |
| ▸ | ACACB | O00763 | 1/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.36 |
| ▸ | GALR3 | O60755 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | BLM | P54132 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | CTSC | P53634 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | MGAM | O43451 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | SI | P14410 | 1/20 | 0.30 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL27788816 | 0.98 | TSHR (0.39) | TSHRTRPV1ACACBCHRM2CHRM4 | |
| SCHEMBL14890562 | 0.85 | TSHR (0.42) | TSHRTRPV1CHRM2CHRM4CHRM1 | |
| SCHEMBL23409576 | 0.81 | CYP2C9 (0.43) | TSHRTRPV1ACACBCHRM2CHRM4 | |
| SCHEMBL8496237 | 0.77 | CTSC (0.36) | ACACBCTSC | |
| SCHEMBL28427630 | 0.76 | TSHR (0.46) | TSHRTRPV1CHRM2CHRM4CHRM1 | |
| SCHEMBL10499840 | 0.75 | TSHR (0.50) | TSHRTRPV1ACACBCHRM2CHRM4 | |
| SCHEMBL1378574 | 0.72 | — | — | |
| SCHEMBL7211173 | 0.72 | CTSC (0.41) | ACACBCTSC | |
| SCHEMBL15069857 | 0.72 | TSHR (0.42) | TSHRTRPV1CHRM2CHRM4CHRM1 | |
| SCHEMBL29173778 | 0.72 | TERT (0.35) | TSHRACACBCHRM2CHRM4CHRM1 |
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-101328186-A | Thienopyrimidine and thienopyridine derivatives useful as anticancer agents | PFIZER PROD INC (US) | 2008-12-24 | — | — | CN | disclosed |
| CN-1280580-A | Thienopyrimidine and thienopyridine derivatives as anticancer agents | PFIZER PROD INC (US) | 2001-01-17 | — | — | CN | disclosed |