Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 3/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | TP53 | P04637 | 2/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.45 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | CKS1B | P61024 | 1/20 | 0.45 |
| ▸ | SKP2 | Q13309 | 1/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.45 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 2/20 | 0.43 |
| ▸ | CA2 | P00918 | 2/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA7 | P43166 | 1/20 | 0.43 |
| ▸ | XDH | P47989 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8733644 | 0.83 | CA1 (0.49) | HPGDLMNACA1CA2AR | |
| SCHEMBL6825689 | 0.77 | CA1 (0.56) | HPGDLMNAALDH1A1TP53ALOX15 | |
| SCHEMBL8451865 | 0.77 | CA1 (0.56) | HPGDLMNAALDH1A1TP53ALOX15 | |
| SCHEMBL8408482 | 0.76 | HPGD (0.70) | HPGDLMNAALDH1A1TP53ALOX15 | |
| SCHEMBL15660164 | 0.74 | CA1 (0.59) | HPGDLMNAALDH1A1TP53ALOX15 | |
| SCHEMBL8450255 | 0.74 | HPGD (0.49) | HPGDLMNAALDH1A1TP53ALOX15 | |
| SCHEMBL542210 | 0.73 | CA1 (0.57) | HPGDLMNAALDH1A1TP53ALOX15 | |
| SCHEMBL8890420 | 0.73 | HIF1A (0.55) | HPGDLMNAALDH1A1HSD17B10CYP1A2 | |
| SCHEMBL21588079 | 0.72 | HPGD (0.68) | HPGDLMNACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL9233919 | 0.72 | TSHR (0.62) | HPGDLMNACA1CA2CA12 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1999064379-A2 | BIOMIMETIC COMBINATORIAL SYNTHESIS | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 1999-12-16 | — | — | WO | disclosed |