Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.69 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.69 |
| ▸ | GAA | P10253 | 2/20 | 0.69 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.69 |
| ▸ | HTT | P42858 | 1/20 | 0.69 |
| ▸ | PADI4 | Q9UM07 | 1/20 | 0.69 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.68 |
| ▸ | USP2 | O75604 | 1/20 | 0.68 |
| ▸ | TSHR | P16473 | 1/20 | 0.68 |
| ▸ | PARP1 | P09874 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 3/20 | 0.49 |
| ▸ | TUBB4A | P04350 | 2/20 | 0.46 |
| ▸ | TUBB | P07437 | 2/20 | 0.46 |
| ▸ | TUBA3C | P0DPH7 | 2/20 | 0.46 |
| ▸ | TUBA1B | P68363 | 2/20 | 0.46 |
| ▸ | TUBA4A | P68366 | 2/20 | 0.46 |
| ▸ | TUBB4B | P68371 | 2/20 | 0.46 |
| ▸ | TUBB3 | Q13509 | 2/20 | 0.46 |
| ▸ | TUBB2A | Q13885 | 2/20 | 0.46 |
| ▸ | TUBB8 | Q3ZCM7 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL3309109 | 0.82 | TUBB4A (0.60) | ALDH1A1KDM4EGAANPSR1HTT | |
| SCHEMBL10204428 | 0.82 | ALDH1A1 (0.71) | ALDH1A1KDM4EGAANPSR1HTT | |
| SCHEMBL3580260 | 0.82 | ALDH1A1 (1.00) | ALDH1A1KDM4EGAANPSR1HTT | |
| SCHEMBL10204429 | 0.81 | ALDH1A1 (0.69) | ALDH1A1KDM4EGAANPSR1HTT | |
| SCHEMBL28839540 | 0.75 | MAP2K1 (0.52) | ALDH1A1KDM4EGAANPSR1HTT | |
| SCHEMBL8786230 | 0.75 | ALDH1A1 (0.47) | ALDH1A1KDM4EGAANPSR1HTT | |
| SCHEMBL29070850 | 0.74 | ALDH1A1 (0.60) | ALDH1A1KDM4EGAANPSR1HTT | |
| SCHEMBL1150241 | 0.74 | ALDH1A1 (0.52) | ALDH1A1KDM4EGAANPSR1HTT | |
| SCHEMBL11186265 | 0.72 | KMT2A (0.55) | ALDH1A1KDM4EGAANPSR1HTT | |
| SCHEMBL4061470 | 0.71 | ALDH1A1 (0.53) | ALDH1A1KDM4EGAANPSR1HTT |
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-5658933-A | Substituted heterocyclic carboxamide esters, their preparation and their use as pharmaceuticals | HOECHST AKTIENGESELLSCHAFT (DE) | 1997-08-19 | — | — | US | disclosed |