Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.33 |
| ▸ | CA1 | P00915 | 2/20 | 0.33 |
| ▸ | CA2 | P00918 | 2/20 | 0.33 |
| ▸ | CA7 | P43166 | 2/20 | 0.33 |
| ▸ | CA9 | Q16790 | 2/20 | 0.33 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.33 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.33 |
| ▸ | TLR4 | O00206 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.30 |
| ▸ | LMNA | P02545 | 3/20 | 0.30 |
| ▸ | POLB | P06746 | 3/20 | 0.30 |
| ▸ | TSHR | P16473 | 2/20 | 0.30 |
| ▸ | HTT | P42858 | 2/20 | 0.30 |
| ▸ | LTA4H | P09960 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL13569470 | 0.79 | — | — | |
| SCHEMBL12781078 | 0.76 | CA12 (0.56) | CA12CA1CA2CA7CA9 | |
| SCHEMBL10055405 | 0.73 | RAB9A (0.32) | L3MBTL1KMT2APLA2G2AALDH1A1KDM4E | |
| SCHEMBL13373257 | 0.73 | ACACB (0.31) | — | |
| SCHEMBL14560509 | 0.73 | PLA2G2A (0.49) | CA12CA1CA2CA7CA9 | |
| SCHEMBL19578975 | 0.72 | ELANE (0.37) | KMT2AALDH1A1KDM4ESMN1; SMN2LMNA | |
| SCHEMBL2022996 | 0.71 | APP (0.35) | ALDH1A1KDM4ESMN1; SMN2LMNAPOLB | |
| SCHEMBL10055481 | 0.70 | RAB9A (0.32) | L3MBTL1SMN1; SMN2RAB9ANPC1MAPT | |
| SCHEMBL16709262 | 0.70 | ACACB (0.50) | CA12CA1CA2CA7CA9 | |
| SCHEMBL10055299 | 0.70 | SLC2A1 (0.35) | SLC2A1L3MBTL1KMT2AALDH1A1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-8288497-B2 | Synthesis of poly-(P-aryleneethynylene)s in neat water under aerobic conditions | THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 2012-10-16 | — | — | US | disclosed |