Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 7/20 | 0.65 |
| ▸ | PPARG | P37231 | 1/20 | 0.42 |
| ▸ | NQO1 | P15559 | 1/20 | 0.38 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.38 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.38 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.36 |
| ▸ | MMP12 | P39900 | 1/20 | 0.36 |
| ▸ | MMP13 | P45452 | 1/20 | 0.36 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9738780 | 0.87 | ABCB1 (0.64) | ABCB1PPARGNQO1MTNR1AMTNR1B | |
| SCHEMBL9739889 | 0.81 | ABCB1 (0.71) | ABCB1PPARGMTNR1AMTNR1BRAB9A | |
| Hydrochloric Acid SCHEMBL9744499 | 0.80 | ABCB1 (0.69) | ABCB1PPARGMTNR1AMTNR1BRAB9A | |
| SCHEMBL9739542 | 0.80 | ABCB1 (0.69) | ABCB1MTNR1AMTNR1B | |
| SCHEMBL9739013 | 0.80 | ABCB1 (0.56) | ABCB1PPARGNQO1MTNR1AMTNR1B | |
| SCHEMBL9738669 | 0.79 | ABCB1 (1.00) | ABCB1MTNR1AMTNR1BRAB9ANPC1 | |
| Hydrochloric Acid SCHEMBL9750425 | 0.79 | ABCB1 (0.68) | ABCB1MTNR1AMTNR1B | |
| SCHEMBL9739975 | 0.79 | ABCB1 (1.00) | ABCB1MTNR1AMTNR1BRAB9ANPC1 | |
| Hydrochloric Acid SCHEMBL9741907 | 0.79 | ABCB1 (0.98) | ABCB1MTNR1AMTNR1BRAB9ANPC1 | |
| SCHEMBL9738472 | 0.76 | ABCB1 (0.40) | ABCB1PPARGHSD17B3 |
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-1992017464-A1 | PHARMACOLOGICALLY ACTIVE α-AMINOETHYL-2-BENZOFURANE METHANOLS SUBSTITUTED IN POSITION 3 | NOE CHRISTIAN R (AT) | 1992-10-15 | — | — | WO | disclosed |