Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.48 |
| ▸ | CA1 | P00915 | 1/20 | 0.48 |
| ▸ | CA2 | P00918 | 1/20 | 0.48 |
| ▸ | CA9 | Q16790 | 1/20 | 0.48 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.45 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.45 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | PPARG | P37231 | 1/20 | 0.40 |
| ▸ | PPARA | Q07869 | 1/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.39 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL29551674 | 0.83 | CA12 (0.61) | CA12CA1CA2CA9ENPP3 | |
| SCHEMBL3633054 | 0.83 | CA12 (0.61) | CA12CA1CA2CA9ENPP3 | |
| SCHEMBL23198145 | 0.83 | CA12 (0.48) | CA12CA1CA2CA9ENPP3 | |
| Tannin Pyrogallol SCHEMBL28281926 | 0.81 | CA12 (0.55) | CA12CA1CA2CA9ENPP3 | |
| SCHEMBL3294993 | 0.81 | CA12 (0.55) | CA12CA1CA2CA9ENPP3 | |
| SCHEMBL29706107 | 0.81 | ESR2 (0.54) | CA12CA1CA2CA9ENPP3 | |
| SCHEMBL616 | 0.81 | ESR2 (0.54) | CA12CA1CA2CA9ENPP3 | |
| SCHEMBL4541662 | 0.81 | CA12 (0.59) | CA12CA1CA2CA9ENPP3 | |
| SCHEMBL29551646 | 0.81 | CA12 (0.59) | CA12CA1CA2CA9ENPP3 | |
| SCHEMBL1313610 | 0.81 | CA12 (0.52) | CA12CA1CA2CA9ENPP3 |
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 |
|---|---|---|---|---|---|---|---|
| US-6316595-B1 | PNA synthesis using a base-labile amino protecting group | AVENTIS PHARMA DEUTSCHLAND GMBH (DE) | 2001-11-13 | — | — | US | disclosed |
| US-6121418-A | PNA synthesis using a base-labile amino protecting group | HOECHST AKTIENGESELLSCHAFT (DE) | 2000-09-19 | — | — | US | disclosed |