Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.59 |
| ▸ | TSHR | P16473 | 2/20 | 0.59 |
| ▸ | RECQL | P46063 | 2/20 | 0.59 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.59 |
| ▸ | HPGD | P15428 | 2/20 | 0.59 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.59 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.59 |
| ▸ | HTT | P42858 | 2/20 | 0.54 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 3/20 | 0.45 |
| ▸ | THRB | P10828 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL6331423 | 0.85 | HSP90AB1 (0.67) | ALDH1A1TSHRRECQLTDP1HPGD | |
| SCHEMBL2125979 | 0.84 | ALDH1A1 (0.65) | ALDH1A1TSHRRECQLTDP1HPGD | |
| SCHEMBL11582407 | 0.82 | CA1 (0.47) | ALDH1A1TSHRHPGDALOX15HSD17B10 | |
| SCHEMBL11230620 | 0.82 | TSHR (0.52) | ALDH1A1TSHRRECQLTDP1HPGD | |
| SCHEMBL31166012 | 0.81 | HTT (0.77) | ALDH1A1TSHRRECQLTDP1HPGD | |
| SCHEMBL3662473 | 0.81 | HTT (0.77) | ALDH1A1TSHRRECQLTDP1HPGD | |
| SCHEMBL11581595 | 0.81 | MEN1 (0.50) | ALDH1A1TSHRTDP1HPGDALOX15 | |
| SCHEMBL7447640 | 0.81 | ABL1 (0.56) | ALDH1A1TSHRRECQLTDP1HPGD | |
| SCHEMBL6744997 | 0.81 | TSHR (0.51) | ALDH1A1TSHRRECQLTDP1HPGD | |
| SCHEMBL5570026 | 0.80 | ERCC5 (0.57) | ALDH1A1TSHRRECQLTDP1HPGD |
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 |
|---|---|---|---|---|---|---|---|
| WO-2001066534-A2 | CYCLIC AND BICYCLIC DIAMINO HISTAMINE-3 RECEPTOR ANTAGONISTS | ABBOTT LABORATORIES (US) | 2001-09-13 | — | — | WO | disclosed |
| WO-1999009979-A1 | METHOD FOR TREATING NEUROPATHIC PAIN | ELI LILLY AND COMPANY (US) | 1999-03-04 | — | — | WO | disclosed |