Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | ADH1B | P00325 | 1/20 | 0.32 |
| ▸ | ADH1C | P00326 | 1/20 | 0.32 |
| ▸ | ADH1A | P07327 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL24856 | 0.92 | — | — | |
| SCHEMBL5795391 | 0.88 | ALDH1A1 (0.40) | ALDH1A1ADH1BADH1CADH1ATSHR | |
| Phosphine SCHEMBL21380516 | 0.88 | ALDH1A1 (0.40) | ALDH1A1ADH1BADH1CADH1ATSHR | |
| SCHEMBL6577079 | 0.88 | ALDH1A1 (0.40) | ALDH1A1ADH1BADH1CADH1ATSHR | |
| SCHEMBL10703282 | 0.88 | ALDH1A1 (0.40) | ALDH1A1ADH1BADH1CADH1ATSHR | |
| Hydrochloric Acid SCHEMBL9395320 | 0.88 | ALDH1A1 (0.40) | ALDH1A1ADH1BADH1CADH1ATSHR | |
| SCHEMBL15400759 | 0.88 | ALDH1A1 (0.40) | ALDH1A1ADH1BADH1CADH1ATSHR | |
| Water SCHEMBL20597605 | 0.88 | ALDH1A1 (0.40) | ALDH1A1ADH1BADH1CADH1ATSHR | |
| Methyl Alcohol SCHEMBL28414164 | 0.85 | ALDH1A1 (0.38) | ALDH1A1ADH1BADH1CADH1ATSHR | |
| Isopropyl Alcohol SCHEMBL7592214 | 0.81 | ALDH1A1 (0.43) | ALDH1A1ADH1BADH1CADH1ATSHR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-2023055530-A | Foaming agent for cement composition | 第一工業製薬株式会社 | 2023-04-18 | — | — | JP | disclosed |
| US-5681890-A | POLYESTER RESIN; MELAMINE RESIN CURING AGENT; NEUTRALIZED SULFONIC ACID COMPOUND CURING CATALYST; FUNCTIONALIZED POLYSILOXANE | KANSAI PAINT CO., LTD. (JP) | 1997-10-28 | — | — | US | disclosed |