Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.41 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.40 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.40 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.40 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | MMP2 | P08253 | 3/20 | 0.39 |
| ▸ | MMP9 | P14780 | 2/20 | 0.39 |
| ▸ | MMP13 | P45452 | 2/20 | 0.39 |
| ▸ | MMP8 | P22894 | 1/20 | 0.39 |
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | MMP1 | P03956 | 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 | |
|---|---|---|---|---|
| SCHEMBL11366155 | 0.84 | ALDH1A1 (0.42) | ALDH1A1TSHRSLC6A2SLC6A4MMP2 | |
| SCHEMBL3340746 | 0.83 | ADAMTS4 (0.49) | ALDH1A1POLBTSHRCHRNB2CHRNB4 | |
| SCHEMBL3340749 | 0.83 | ADAMTS4 (0.49) | ALDH1A1POLBTSHRCHRNB2CHRNB4 | |
| SCHEMBL7402365 | 0.81 | ALDH1A1 (0.43) | ALDH1A1POLBTDP1TSHRALOX15 | |
| SCHEMBL7801107 | 0.81 | ALDH1A1 (0.43) | ALDH1A1POLBTDP1TSHRALOX15 | |
| SCHEMBL14969086 | 0.81 | ADAMTS4 (0.59) | ALDH1A1MMP2MMP9MMP13MMP8 | |
| SCHEMBL11674351 | 0.80 | ALDH1A1 (0.37) | ALDH1A1POLBTDP1TSHRCHRNB2 | |
| SCHEMBL11173234 | 0.79 | ALDH1A1 (0.44) | ALDH1A1POLBTDP1TSHRALOX15 | |
| SCHEMBL14843771 | 0.79 | CHRM5 (0.42) | ALDH1A1MMP2MMP9MMP13MMP8 | |
| SCHEMBL11201077 | 0.78 | MMP2 (0.35) | ALDH1A1POLBTDP1TSHRALOX15 |
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 |
|---|---|---|---|---|---|---|---|
| US-4411912-A | Insecticidal isovaleric acid esters | ZOECON CORPORATION (US) | 1983-10-25 | — | — | US | disclosed |
| US-4243819-A | Substituted amino acids | ZOECON CORPORATION (US) | 1981-01-06 | — | — | US | disclosed |