Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.46 |
| ▸ | TPMT | P51580 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | NQO2 | P16083 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA3 | P07451 | 1/20 | 0.39 |
| ▸ | CA4 | P22748 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9340393 | 0.91 | HSD17B10 (0.45) | HSD17B10TPMTALDH1A1KDM4EGAA | |
| SCHEMBL6775493 | 0.89 | HSD17B10 (0.46) | HSD17B10TPMTALDH1A1KDM4EGAA | |
| SCHEMBL6772316 | 0.86 | HSD17B10 (0.44) | HSD17B10TPMTALDH1A1KDM4EGAA | |
| SCHEMBL7321975 | 0.86 | TPMT (0.46) | HSD17B10TPMTALDH1A1KDM4EGAA | |
| SCHEMBL11468821 | 0.86 | HSD17B10 (0.47) | HSD17B10TPMTALDH1A1KDM4EGAA | |
| SCHEMBL7357713 | 0.85 | HSD17B10 (0.42) | HSD17B10TPMTALDH1A1KDM4EGAA | |
| SCHEMBL7360614 | 0.85 | HSD17B10 (0.42) | HSD17B10TPMTALDH1A1KDM4EGAA | |
| SCHEMBL8804900 | 0.84 | TPMT (0.47) | HSD17B10TPMTALDH1A1KDM4EGAA | |
| SCHEMBL13255342 | 0.84 | GAA (0.57) | HSD17B10ALDH1A1KDM4EGAAHPGD | |
| SCHEMBL5925643 | 0.82 | ACHE (0.43) | HSD17B10TPMTALDH1A1KDM4EGAA |
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-1990006309-A1 | HETEROAZABENZOBICYCLIC CARBOXAMIDE 5-HT3, ANTAGONISTS | RORER INTERNATIONAL (OVERSEAS) INC. (US) | 1990-06-14 | — | — | WO | disclosed |
| US-4933445-A | Heteroazabenzobicyclic carboxamide 5-HT3 antagonists | RORER PHARMACEUTICAL CORPORATION (US) | 1990-06-12 | — | — | US | disclosed |