Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.43 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.40 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.40 |
| ▸ | PTGER3 | P43115 | 1/20 | 0.40 |
| ▸ | PTGER2 | P43116 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 3/20 | 0.38 |
| ▸ | CA2 | P00918 | 3/20 | 0.38 |
| ▸ | CA4 | P22748 | 3/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | MIF | P14174 | 1/20 | 0.37 |
| ▸ | AKR1B10 | O60218 | 2/20 | 0.37 |
| ▸ | MMP2 | P08253 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL11306367 | 0.82 | ESR1 (0.42) | ESR1PTGER1PTGER4PTGER3PTGER2 | |
| SCHEMBL30555699 | 0.82 | CA1 (0.43) | ESR1PTGER1PTGER4PTGER3PTGER2 | |
| SCHEMBL2390077 | 0.79 | ESR1 (0.36) | ESR1PTGER1PTGER4PTGER3PTGER2 | |
| SCHEMBL29113970 | 0.79 | CA1 (0.40) | ESR1PTGER1PTGER4PTGER3PTGER2 | |
| SCHEMBL22991749 | 0.78 | CA1 (0.43) | ESR1PTGER1PTGER4PTGER3PTGER2 | |
| SCHEMBL2394180 | 0.78 | ESR1 (0.51) | ESR1PTGER1PTGER4PTGER3PTGER2 | |
| SCHEMBL2392799 | 0.74 | PTGER3 (0.38) | ESR1PTGER1PTGER4PTGER3PTGER2 | |
| SCHEMBL6855197 | 0.72 | CA1 (0.47) | ESR1PTGER1PTGER4PTGER3PTGER2 | |
| SCHEMBL2865033 | 0.72 | CA1 (0.47) | ESR1PTGER1PTGER4PTGER3PTGER2 | |
| SCHEMBL7050926 | 0.71 | HMGB1 (0.49) | CYP3A4CYP2C9MMP2CSNK2A1ALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-RE42700-E1 | Induction of apoptosis in cancer cells | SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE (US) | 2011-09-13 | — | — | US | disclosed |
| US-4281080-A | TACKIFIERS FOR RUBBERS | THE GOODYEAR TIRE & RUBBER COMPANY (US) | 1981-07-28 | — | — | US | disclosed |
| US-4010140-A | Age resistant resin compositions and admixtures useful as adhesives | THE GOODYEAR TIRE & RUBBER COMPANY (US) | 1977-03-01 | — | — | US | disclosed |