Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.50 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.47 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.45 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.39 |
| ▸ | LTA4H | P09960 | 1/20 | 0.39 |
| ▸ | CCR1 | P32246 | 1/20 | 0.39 |
| ▸ | TNKS | O95271 | 1/20 | 0.38 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.38 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.38 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.38 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.38 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.38 |
| ▸ | SGMS2 | Q8NHU3 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11147918 | 0.84 | PTGS1 (0.54) | ALDH1A1TDP1PTGS1MEN1KMT2A | |
| SCHEMBL9862906 | 0.81 | ALDH1A1 (0.59) | ALDH1A1TDP1PTGS1MEN1KMT2A | |
| SCHEMBL9863162 | 0.81 | ALDH1A1 (0.59) | ALDH1A1TDP1PTGS1MEN1KMT2A | |
| SCHEMBL10397026 | 0.81 | ALDH1A1 (0.59) | ALDH1A1TDP1PTGS1MEN1KMT2A | |
| SCHEMBL9751873 | 0.80 | ALDH1A1 (0.50) | ALDH1A1TDP1PTGS1MEN1KMT2A | |
| SCHEMBL9304481 | 0.80 | ALDH1A1 (0.47) | ALDH1A1TDP1PTGS1MEN1KMT2A | |
| SCHEMBL17081249 | 0.80 | ALDH1A1 (0.50) | ALDH1A1TDP1PTGS1MEN1KMT2A | |
| SCHEMBL1677135 | 0.80 | TSHR (0.60) | ALDH1A1TDP1PTGS1MEN1KMT2A | |
| SCHEMBL192456 | 0.80 | TSHR (0.60) | ALDH1A1TDP1PTGS1MEN1KMT2A | |
| SCHEMBL30045078 | 0.80 | TSHR (0.60) | ALDH1A1TDP1PTGS1MEN1KMT2A |
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-4985365-A | WITH AN ESTERASE FROM A MICROORGANISM, ASSYMETRIC HYDROLYSIS | SUMITOMO CHEMICAL COMPANY, LTD. (JP) | 1991-01-15 | — | — | US | disclosed |