Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 4/20 | 0.58 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.44 |
| ▸ | MEN1 | O00255 | 4/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | MLNR | O43193 | 1/20 | 0.40 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.40 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.40 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9545778 | 0.83 | PTGS2 (0.62) | PTGS2HSD17B10MEN1KMT2ACYP2C9 | |
| SCHEMBL13588988 | 0.82 | PTGS2 (0.58) | PTGS2HSD17B10MEN1KMT2ACYP2C9 | |
| SCHEMBL12987782 | 0.81 | MEN1 (0.49) | HSD17B10MEN1KMT2ACYP2C9ALOX15 | |
| SCHEMBL12986933 | 0.79 | KMT2A (0.47) | HSD17B10MEN1KMT2ACYP2C9ALOX15 | |
| SCHEMBL12987053 | 0.79 | KMT2A (0.47) | PTGS2HSD17B10MEN1KMT2ACYP2C9 | |
| SCHEMBL12986889 | 0.79 | KMT2A (0.47) | HSD17B10MEN1KMT2ACYP2C9ALOX15 | |
| SCHEMBL12986566 | 0.79 | MEN1 (0.47) | HSD17B10MEN1KMT2ACYP2C9ALOX15 | |
| SCHEMBL4553089 | 0.77 | PTGS2 (0.67) | PTGS2HSD17B10MEN1KMT2ALMNA | |
| SCHEMBL15639697 | 0.76 | SYK (0.45) | PTGS2HSD17B10CYP2C9LMNAALDH1A1 | |
| SCHEMBL15889887 | 0.76 | PTGS2 (0.85) | PTGS2HSD17B10MEN1KMT2ACYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2693876-A1 | SUBSTITUTED METHYLFORMYL REAGENTS AND METHOD OF USING SAME TO MODIFY PHYSICOCHEMICAL AND/OR PHARMACOKINETIC PROPERTIES OF COMPOUNDS | Sphaera Pharma Pte. Ltd (SG) | 2014-02-12 | — | — | EP | claimed |
| WO-2012137225-A1 | SUBSTITUTED METHYLFORMYL REAGENTS AND METHOD OF USING SAME TO MODIFY PHYSICOCHEMICAL AND/OR PHARMACOKINETIC PROPERTIES OF COMPOUNDS | SPHAERA PHARMA PVT. LTD (IN) | 2012-10-11 | — | — | WO | claimed |