Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | TPMT | P51580 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | APEX1 | P27695 | 1/20 | 0.34 |
| ▸ | PRKAB2 | O43741 | 2/20 | 0.33 |
| ▸ | PRKAG1 | P54619 | 2/20 | 0.33 |
| ▸ | PRKAA2 | P54646 | 2/20 | 0.33 |
| ▸ | PRKAA1 | Q13131 | 2/20 | 0.33 |
| ▸ | PRKAG3 | Q9UGI9 | 2/20 | 0.33 |
| ▸ | PRKAG2 | Q9UGJ0 | 2/20 | 0.33 |
| ▸ | PRKAB1 | Q9Y478 | 2/20 | 0.33 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7307695 | 0.80 | HSD17B10 (0.41) | HSD17B10HTTTPMTKDM4EALDH1A1 | |
| SCHEMBL7394590 | 0.77 | TPMT (0.41) | HSD17B10HTTTPMTKDM4EALDH1A1 | |
| SCHEMBL7318004 | 0.75 | HTR3A (0.55) | MEN1KMT2A | |
| SCHEMBL7415324 | 0.75 | HSD17B10 (0.42) | HSD17B10HTTTPMTKDM4EALDH1A1 | |
| SCHEMBL4474510 | 0.75 | TPMT (0.44) | HSD17B10HTTTPMTKDM4EALDH1A1 | |
| SCHEMBL22225985 | 0.74 | KDM4E (0.39) | HSD17B10KDM4EALDH1A1LMNAPOLB | |
| SCHEMBL27435302 | 0.74 | ALDH1A1 (0.44) | HSD17B10HTTTPMTKDM4EALDH1A1 | |
| SCHEMBL4471890 | 0.72 | TPMT (0.42) | HSD17B10HTTTPMTKDM4EALDH1A1 | |
| SCHEMBL27432589 | 0.71 | TSHR (0.35) | HTTHPGDMEN1KMT2ATSHR | |
| SCHEMBL7417517 | 0.70 | HTR4 (0.42) | KDM4EALDH1A1LMNAPOLB |
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-4933445-A | Heteroazabenzobicyclic carboxamide 5-HT3 antagonists | RORER PHARMACEUTICAL CORPORATION (US) | 1990-06-12 | — | — | US | disclosed |