Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 2/20 | 0.68 |
| ▸ | ABL1 | P00519 | 2/20 | 0.64 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.64 |
| ▸ | BCR | P11274 | 2/20 | 0.64 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.61 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.61 |
| ▸ | CYP2E1 | P05181 | 2/20 | 0.61 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.61 |
| ▸ | CYP2C8 | P10632 | 2/20 | 0.61 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.61 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.61 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.61 |
| ▸ | CYP4B1 | P13584 | 2/20 | 0.61 |
| ▸ | CYP2B6 | P20813 | 2/20 | 0.61 |
| ▸ | CYP3A5 | P20815 | 2/20 | 0.61 |
| ▸ | CYP2A7 | P20853 | 2/20 | 0.61 |
| ▸ | CYP3A7 | P24462 | 2/20 | 0.61 |
| ▸ | CYP2F1 | P24903 | 2/20 | 0.61 |
| ▸ | CYP2C18 | P33260 | 2/20 | 0.61 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.61 |
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 | |
|---|---|---|---|---|
| SCHEMBL12871359 | 0.96 | ABL1 (0.71) | ACHEABL1ABCB1BCRCYP1A1 | |
| SCHEMBL1180429 | 0.86 | ABL1 (0.83) | ABL1ABCB1BCRCYP1A1CYP1A2 | |
| SCHEMBL20022136 | 0.85 | ABL1 (0.69) | ACHEABL1ABCB1BCRCYP1A1 | |
| SCHEMBL20022108 | 0.85 | ABL1 (0.69) | ACHEABL1ABCB1BCRCYP1A1 | |
| SCHEMBL12871361 | 0.85 | ABL1 (0.63) | ACHEABL1ABCB1BCRCYP1A1 | |
| SCHEMBL20022095 | 0.84 | ABL1 (0.72) | ACHEABL1ABCB1BCRCYP1A1 | |
| Benzene SCHEMBL11242974 | 0.83 | ACHE (0.88) | ACHERELANPC1RAB9AKMT2A | |
| SCHEMBL1047258 | 0.83 | ALKBH3 (0.65) | ACHEABL1ABCB1BCRCYP1A1 | |
| SCHEMBL25873212 | 0.83 | ALKBH3 (0.65) | ACHEABL1ABCB1BCRCYP1A1 | |
| SCHEMBL1133171 | 0.83 | ABL1 (0.66) | ACHEABL1ABCB1BCRCYP1A1 |
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-4318783-A | Process for the preparation of optionally substituted benzaldehyde dialkyl acetals | BAYER AKTIENGESELLSCHAFT (DE) | 1982-03-09 | — | — | US | disclosed |