Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.64 |
| ▸ | TSHR | P16473 | 2/20 | 0.64 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.64 |
| ▸ | USP2 | O75604 | 2/20 | 0.64 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | THRB | P10828 | 1/20 | 0.50 |
| ▸ | APEX1 | P27695 | 1/20 | 0.50 |
| ▸ | RECQL | P46063 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 8/20 | 0.49 |
| ▸ | LMNA | P02545 | 4/20 | 0.49 |
| ▸ | NPC1 | O15118 | 3/20 | 0.49 |
| ▸ | RAB9A | P51151 | 3/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL2427902 | 0.81 | ALDH1A1 (0.86) | ALDH1A1TSHRHSD17B10USP2MAPT | |
| SCHEMBL11263201 | 0.79 | ALDH1A1 (0.47) | ALDH1A1TSHRHSD17B10USP2MEN1 | |
| SCHEMBL1046759 | 0.79 | ALDH1A1 (1.00) | ALDH1A1TSHRHSD17B10USP2POLB | |
| SCHEMBL13116713 | 0.75 | MAPK1 (0.49) | ALDH1A1TSHRHSD17B10KMT2AMAPT | |
| SCHEMBL14982060 | 0.74 | ALDH1A1 (0.88) | ALDH1A1TSHRHSD17B10USP2POLB | |
| SCHEMBL598515 | 0.73 | ALDH1A1 (0.72) | ALDH1A1TSHRHSD17B10USP2LMNA | |
| SCHEMBL28752 | 0.72 | ALDH1A1 (0.66) | ALDH1A1TSHRHSD17B10POLBMAPT | |
| Hydrochloric Acid SCHEMBL4652111 | 0.72 | ALDH1A1 (0.70) | ALDH1A1TSHRHSD17B10USP2LMNA | |
| SCHEMBL232986 | 0.72 | ALDH1A1 (0.65) | ALDH1A1TSHRHSD17B10USP2MEN1 | |
| SCHEMBL14413533 | 0.72 | ALDH1A1 (0.65) | ALDH1A1TSHRHSD17B10USP2LMNA |
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 |
|---|---|---|---|---|---|---|---|
| US-4328223-A | 2-Amino-3a,4,5,6-tetrahydro-perimidine derivatives and their medicinal use in combatting circulatory diseases | BAYER AKTIENGESELLSCHAFT (DE) | 1982-05-04 | — | — | US | disclosed |