Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MIF | P14174 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CES2 | O00748 | 2/20 | 0.44 |
| ▸ | CES1 | P23141 | 2/20 | 0.44 |
| ▸ | CA1 | P00915 | 5/20 | 0.43 |
| ▸ | CA2 | P00918 | 5/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | NAAA | Q02083 | 1/20 | 0.42 |
| ▸ | PARP1 | P09874 | 1/20 | 0.42 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.42 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.42 |
| ▸ | PARP4 | Q9UKK3 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 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 | |
|---|---|---|---|---|
| SCHEMBL26250104 | 0.79 | ALDH1A1 (0.45) | MIFALDH1A1CYP1A2CES2CES1 | |
| SCHEMBL1031217 | 0.74 | CES2 (0.53) | CES2CES1CA1CA2RAB9A | |
| SCHEMBL5215589 | 0.73 | CES2 (0.57) | ALDH1A1CYP1A2CES2CES1CA1 | |
| SCHEMBL4700596 | 0.73 | MIF (0.64) | MIFALDH1A1CYP1A2CA1CA2 | |
| SCHEMBL12453 | 0.73 | CES2 (0.61) | ALDH1A1CYP1A2CES2CES1CA1 | |
| Hydrochloric Acid SCHEMBL6540579 | 0.72 | CA1 (0.53) | ALDH1A1CYP1A2CES2CES1CA1 | |
| SCHEMBL18398873 | 0.72 | MIF (0.62) | MIFALDH1A1CYP1A2CA1CA2 | |
| SCHEMBL16162246 | 0.72 | MEN1 (0.58) | ALDH1A1CYP1A2CES2CES1CA1 | |
| SCHEMBL20422083 | 0.72 | MIF (0.62) | MIFALDH1A1CYP1A2CA1CA2 | |
| SCHEMBL68736 | 0.72 | CES2 (0.55) | ALDH1A1CYP1A2CES2CES1CA1 |
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-4451471-A | Certain 2,4,5-tri-substituted thiazoles, pharmaceutical compositions containing same and methods of using same | CIBA-GEIGY CORPORATION (US) | 1984-05-29 | — | — | US | disclosed |