Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | PLIN1 | O60240 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | PLIN5 | Q00G26 | 1/20 | 0.43 |
| ▸ | ABHD5 | Q8WTS1 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11296757 | 0.83 | SMN1; SMN2 (0.51) | TSHRMEN1KMT2AALDH1A1MAPT | |
| SCHEMBL1626840 | 0.81 | CA12 (0.52) | CA12CA9TSHRMEN1KMT2A | |
| SCHEMBL8163196 | 0.79 | CA12 (0.47) | CA12CA9TSHRMEN1KMT2A | |
| SCHEMBL6274022 | 0.78 | ELANE (0.43) | ALDH1A1HPGD | |
| SCHEMBL3421267 | 0.76 | CA12 (0.52) | CA12CA9TSHRMEN1KMT2A | |
| SCHEMBL8183019 | 0.74 | ALDH1A1 (0.49) | CA12CA9ALDH1A1HPGD | |
| SCHEMBL9242647 | 0.73 | TSHR (0.56) | CA12CA9TSHRALDH1A1MAPT | |
| SCHEMBL8359089 | 0.71 | ALDH1A1 (0.57) | TSHRALDH1A1MAPTHPGD | |
| SCHEMBL571794 | 0.71 | ALDH1A1 (0.49) | CA12CA9TSHRMEN1KMT2A | |
| SCHEMBL2182918 | 0.70 | TSHR (0.66) | TSHRMAPTCYP1A2CYP2C19MAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005080406-A2 | COMPOUNDS FOR THE INHIBITION OF UNDESIRED CELL PROLIFERATION AND USE THEREOF | JERINI AG (DE) | 2005-09-01 | — | — | WO | disclosed |