Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | BCHE | P06276 | 2/20 | 0.46 |
| ▸ | ACHE | P22303 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 5/20 | 0.46 |
| ▸ | NPC1 | O15118 | 4/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7731637 | 0.98 | ALDH1A1 (0.54) | ALDH1A1TSHRBCHEACHERAB9A | |
| SCHEMBL2215516 | 0.94 | ALDH1A1 (0.56) | ALDH1A1TSHRRAB9ANPC1SMN1; SMN2 | |
| Aluminum Chloride Anhydrous SCHEMBL27692479 | 0.89 | ALDH1A1 (0.51) | ALDH1A1TSHRRAB9ANPC1SMN1; SMN2 | |
| SCHEMBL1573285 | 0.87 | ALDH1A1 (0.59) | ALDH1A1TSHRRAB9ANPC1SMN1; SMN2 | |
| SCHEMBL7313318 | 0.86 | ERN1 (0.39) | ALDH1A1TSHRBCHEACHERAB9A | |
| SCHEMBL6754408 | 0.86 | MAPT (0.54) | ALDH1A1TSHRBCHEACHERAB9A | |
| SCHEMBL4609127 | 0.86 | MAPT (0.54) | ALDH1A1TSHRBCHEACHERAB9A | |
| SCHEMBL4610015 | 0.86 | MAPT (0.54) | ALDH1A1TSHRBCHEACHERAB9A | |
| SCHEMBL7723468 | 0.84 | ALDH1A1 (0.49) | ALDH1A1TSHRBCHEACHERAB9A | |
| SCHEMBL6754133 | 0.84 | ALDH1A1 (0.51) | ALDH1A1TSHRRAB9ANPC1SMN1; SMN2 |
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-6476266-B1 | Diamino compound and production process for the same | CHISSO CORPORATION (JP) | 2002-11-05 | — | — | US | disclosed |