Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | CETP | P11597 | 3/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | CNR2 | P34972 | 2/20 | 0.44 |
| ▸ | MBOAT4 | Q96T53 | 1/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.44 |
| ▸ | CTSL | P07711 | 1/20 | 0.43 |
| ▸ | CTSS | P25774 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| Tetrabuthylammonium SCHEMBL9033781 | 0.88 | ALDH1A1 (0.49) | ALDH1A1MAPK1L3MBTL1TDP1CYP3A4 | |
| Tetrabuthylammonium SCHEMBL10914794 | 0.83 | ALDH1A1 (0.50) | ALDH1A1MAPK1L3MBTL1TDP1CYP3A4 | |
| Tetrabuthylammonium SCHEMBL11095269 | 0.83 | ALDH1A1 (0.50) | ALDH1A1MAPK1L3MBTL1TDP1CYP3A4 | |
| SCHEMBL931107 | 0.82 | ALDH1A1 (0.63) | ALDH1A1MAPK1L3MBTL1TDP1TSHR | |
| SCHEMBL9562211 | 0.80 | ALDH1A1 (0.63) | ALDH1A1MAPK1L3MBTL1TDP1CYP3A4 | |
| Tetrabuthylammonium SCHEMBL28773590 | 0.79 | ALDH1A1 (0.44) | ALDH1A1MAPK1L3MBTL1TDP1CYP3A4 | |
| Trimethylammonium SCHEMBL7965217 | 0.79 | ALDH1A1 (0.60) | ALDH1A1MAPK1L3MBTL1TDP1CYP3A4 | |
| Bromide SCHEMBL11825947 | 0.78 | ALDH1A1 (0.54) | ALDH1A1MAPK1L3MBTL1TDP1CYP3A4 | |
| Hydrazine SCHEMBL6220248 | 0.78 | ALDH1A1 (0.59) | ALDH1A1MAPK1L3MBTL1TDP1KMT2A | |
| SCHEMBL20023006 | 0.78 | TSHR (0.61) | ALDH1A1MAPK1L3MBTL1TDP1CYP3A4 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5589592-A | Process for preparing β-lactam derivative and synthetic intermediate | TANABE SEIYAKU CO., LTD. (JP) | 1996-12-31 | — | — | US | disclosed |
| US-5414081-A | Treating a 1-aza-3-thiabicycloalkane with base and phosphine or phosphite desulfurizing agent, and reacting the product with an active esterifying agent | TANABE SEIYAKU CO., LTD. (JP) | 1995-05-09 | — | — | US | disclosed |
| EP-0559533-A1 | Process for preparing beta-lactam derivative and synthetic intermediate thereof | TANABE SEIYAKU CO., LTD. (JP) | 1993-09-08 | — | — | EP | disclosed |
| CN-86106583-A | The preparation method of antibiotic | — | 1987-04-22 | — | — | CN | disclosed |