Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DAO | P14920 | 1/20 | 0.68 |
| ▸ | LMNA | P02545 | 5/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.53 |
| ▸ | RAB9A | P51151 | 4/20 | 0.53 |
| ▸ | NPC1 | O15118 | 3/20 | 0.53 |
| ▸ | MEN1 | O00255 | 2/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | CES2 | O00748 | 1/20 | 0.48 |
| ▸ | CES1 | P23141 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 4/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | FPR1 | P21462 | 1/20 | 0.47 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.46 |
| ▸ | FEN1 | P39748 | 1/20 | 0.46 |
| ▸ | HPGDS | O60760 | 1/20 | 0.46 |
| ▸ | GSK3B | P49841 | 1/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| Triethylene Glycol SCHEMBL28097993 | 0.98 | DAO (0.66) | DAOLMNAALDH1A1RAB9ANPC1 | |
| Thiophene Carboxylic Acid SCHEMBL27967104 | 0.91 | DAO (0.56) | DAOLMNAALDH1A1RAB9ANPC1 | |
| Thiophene Carboxylic Acid SCHEMBL28098051 | 0.91 | DAO (0.56) | DAOLMNAALDH1A1RAB9ANPC1 | |
| Thiophene Carboxylic Acid SCHEMBL7062244 | 0.82 | DAO (1.00) | DAOLMNAALDH1A1RAB9ANPC1 | |
| Thiophene Carboxylic Acid SCHEMBL27774764 | 0.82 | DAO (1.00) | DAOLMNAALDH1A1RAB9ANPC1 | |
| Thiophene Carboxylic Acid SCHEMBL83000 | 0.82 | — | — | |
| Thiophene Carboxylic Acid SCHEMBL11452200 | 0.80 | — | — | |
| Thiophene Carboxylic Acid SCHEMBL10898170 | 0.80 | — | — | |
| Thiophene Carboxylic Acid SCHEMBL1814 | 0.80 | — | — | |
| Thiophene Carboxylic Acid SCHEMBL20895852 | 0.80 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-103804659-B | A kind of thieno with poly glycol monomethyl ether side chain [3,4-b] thiophene conjugated polymer material, its preparation method and application thereof | 中国科学院化学研究所 | 2016-09-21 | — | — | CN | disclosed |