Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 3/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.37 |
| ▸ | TSHR | P16473 | 3/20 | 0.37 |
| ▸ | USP2 | O75604 | 2/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | MMP9 | P14780 | 1/20 | 0.32 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.32 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL10691754 | 0.86 | LMNA (0.35) | ALDH1A1TSHRUSP2ALOX15GAA | |
| SCHEMBL1546590 | 0.81 | CYP1A2 (0.38) | ALDH1A1TSHRUSP2ALOX15PKM | |
| SCHEMBL12406856 | 0.81 | CYP1A2 (0.38) | ALDH1A1TSHRUSP2ALOX15PKM | |
| SCHEMBL13210865 | 0.76 | NR1I2 (0.39) | MEN1KMT2ATDP1ALDH1A1TSHR | |
| SCHEMBL12530161 | 0.75 | CCR5 (0.45) | ALDH1A1TSHRUSP2ALOX15PKM | |
| SCHEMBL12283380 | 0.75 | CCR5 (0.45) | ALDH1A1TSHRUSP2ALOX15PKM | |
| SCHEMBL23182529 | 0.73 | GABBR2 (0.42) | MEN1KMT2AALDH1A1TSHRUSP2 | |
| SCHEMBL11862681 | 0.73 | GRIA4 (0.36) | ALDH1A1HPGDNR1I2 | |
| SCHEMBL11852043 | 0.73 | GABBR2 (0.40) | MEN1KMT2ATSHRLMNAMMP9 | |
| SCHEMBL18740520 | 0.72 | APLNR (0.44) | TDP1ALDH1A1TSHRPKM |
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 |
|---|---|---|---|---|---|---|---|
| EP-0253501-A2 | N-disubstituted cycloalkylmethyl amines useful as fungicides | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1988-01-20 | — | — | EP | disclosed |