Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 4/20 | 0.38 |
| ▸ | CA6 | P23280 | 4/20 | 0.38 |
| ▸ | CA7 | P43166 | 4/20 | 0.38 |
| ▸ | CA9 | Q16790 | 4/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 4/20 | 0.38 |
| ▸ | CA5B | Q9Y2D0 | 4/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.38 |
| ▸ | CA2 | P00918 | 3/20 | 0.38 |
| ▸ | CA4 | P22748 | 3/20 | 0.38 |
| ▸ | CA5A | P35218 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | CASP2 | P42575 | 2/20 | 0.38 |
| ▸ | F13A1 | P00488 | 2/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.38 |
| ▸ | THPO | P40225 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | RECQL | P46063 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | CA3 | P07451 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL10938943 | 0.82 | CA12 (0.57) | CA12CA6CA7CA9CA14 | |
| SCHEMBL8310112 | 0.80 | — | — | |
| SCHEMBL3318731 | 0.79 | ODC1 (0.43) | CA12CA6CA7CA9CA14 | |
| SCHEMBL25075483 | 0.78 | ALDH1A1 (0.45) | CYP1A2KMT2ACYP2C19TSHRLMNA | |
| SCHEMBL29160671 | 0.76 | CA12 (0.41) | CA12CA6CA7CA9CA14 | |
| SCHEMBL16767876 | 0.75 | ODC1 (0.39) | LMNA | |
| SCHEMBL25075402 | 0.75 | ALDH1A1 (0.42) | CYP1A2KMT2ACYP2C19MEN1TSHR | |
| SCHEMBL4159314 | 0.74 | MAPK1 (0.48) | CYP1A2KMT2ACYP2C19MEN1RECQL | |
| SCHEMBL9769916 | 0.74 | TDP1 (0.31) | TDP1 | |
| SCHEMBL2128080 | 0.73 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0363843-B1 | Process for the preparation of bis(aminopropoxy)alkanes | AIR PROD & CHEM (US) | 1995-02-15 | — | — | EP | disclosed |
| US-5081305-A | PROCESS FOR THE PREPARATION OF BIS(AMINOPROPOXY)ALKANES | AIR PRODUCTS AND CHEMICALS, INC. (US) | 1992-01-14 | — | — | US | disclosed |
| EP-0363843-A2 | Process for the preparation of bis(aminopropoxy)alkanes | AIR PRODUCTS AND CHEMICALS, INC. (US) | 1990-04-18 | — | — | EP | disclosed |