Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 4/20 | 0.48 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.48 |
| ▸ | CA2 | P00918 | 5/20 | 0.44 |
| ▸ | CA12 | O43570 | 2/20 | 0.44 |
| ▸ | CA3 | P07451 | 2/20 | 0.44 |
| ▸ | CA9 | Q16790 | 2/20 | 0.44 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.44 |
| ▸ | ABAT | P80404 | 1/20 | 0.44 |
| ▸ | CA6 | P23280 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | IDO1 | P14902 | 2/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | HTR3A | P46098 | 1/20 | 0.41 |
| ▸ | BACE1 | P56817 | 1/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL16904622 | 0.76 | ESR1 (0.55) | ESR1ESR2CA2CA12CA3 | |
| SCHEMBL2277823 | 0.75 | APP (0.48) | ALDH1A1KMT2AMEN1CYP3A4MAPT | |
| SCHEMBL7555745 | 0.75 | CYP2A6 (0.44) | ALDH1A1IDO1TAAR1TDP1 | |
| SCHEMBL6572306 | 0.72 | ESR1 (0.52) | ESR1ESR2CA2CA12CA3 | |
| SCHEMBL448467 | 0.72 | MMP3 (0.57) | ESR1ESR2CA2CA12CA3 | |
| SCHEMBL9331371 | 0.72 | TRPA1 (0.52) | ESR1ESR2CA2CA12CA3 | |
| SCHEMBL357871 | 0.72 | ESR1 (0.50) | ESR1ESR2CA2CA12CA3 | |
| SCHEMBL910567 | 0.72 | ESR1 (0.57) | ESR1ESR2CA2CA12CA3 | |
| SCHEMBL147614 | 0.69 | CALM1 (0.43) | ALDH1A1IDO1CYP2C19TAAR1BLM | |
| SCHEMBL28690106 | 0.68 | ESR1 (0.48) | ESR1ESR2CA2ABATKDM4E |
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-4171424-A | Polyesters containing units derived from metal salts of N-hydroxyalkylated branched α-aminoacids | CIBA-GEIGY CORPORATION (US) | 1979-10-16 | — | — | US | disclosed |
| US-4101526-A | Process for the manufacture of linear polyesters which contain phosphites and/or phosphates | CIBA-GEIGY CORPORATION (US) | 1978-07-18 | — | — | US | disclosed |
| US-4093639-A | HEAT RESISTANCE | CIBA-GEIGY CORPORATION (US) | 1978-06-06 | — | — | US | disclosed |