Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAAA | Q02083 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | DGKA | P23743 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | RAD52 | P43351 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | FAAH | O00519 | 1/20 | 0.39 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | DNM1 | Q05193 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Tributyl Citrate SCHEMBL9712117 | 0.98 | NAAA (0.47) | NAAAALDH1A1ATMDGKATSHR | |
| Tributyl Citrate SCHEMBL24668 | 0.98 | NAAA (0.47) | NAAAALDH1A1ATMDGKATSHR | |
| Tributyl Citrate SCHEMBL27852605 | 0.96 | NAAA (0.46) | NAAAALDH1A1ATMDGKATSHR | |
| Tributyl Citrate SCHEMBL28271750 | 0.95 | NAAA (0.44) | NAAAALDH1A1ATMDGKATSHR | |
| SCHEMBL21564006 | 0.95 | NAAA (0.44) | NAAAALDH1A1ATMDGKATSHR | |
| SCHEMBL23981027 | 0.95 | NAAA (0.53) | NAAAALDH1A1ATMDGKATSHR | |
| Tributyl Citrate SCHEMBL28067166 | 0.95 | NAAA (0.44) | NAAAALDH1A1ATMDGKATSHR | |
| SCHEMBL23598224 | 0.95 | NAAA (0.44) | NAAAALDH1A1ATMDGKATSHR | |
| Tributyl Citrate SCHEMBL17870570 | 0.95 | NAAA (0.44) | NAAAALDH1A1ATMDGKATSHR | |
| SCHEMBL30168805 | 0.93 | NAAA (0.56) | NAAAALDH1A1ATMDGKATSHR |
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-108084493-A | A kind of modified calcium carbonate filler containing tributyl citrate and preparation method thereof | 贺州市星辉科技有限公司 | 2018-05-29 | — | — | CN | disclosed |