Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 6/20 | 0.40 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.34 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | RAD52 | P43351 | 1/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 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 | |
|---|---|---|---|---|
| SCHEMBL21593841 | 0.83 | ALDH1A1 (0.38) | ALDH1A1HTTMAPTHPGDTSHR | |
| SCHEMBL24451262 | 0.81 | HTR2C (0.47) | ALDH1A1MAPTSMN1; SMN2LMNA | |
| SCHEMBL14614802 | 0.81 | PDE3B (0.46) | ALDH1A1MAPTKMT2ANPC1MEN1 | |
| SCHEMBL5017571 | 0.81 | KMT2A (0.53) | ALDH1A1HTTMAPTHPGDTSHR | |
| SCHEMBL16250650 | 0.78 | ALDH1A1 (0.43) | ALDH1A1HTTMAPTHPGDTSHR | |
| SCHEMBL21444521 | 0.77 | HTR2A (0.33) | — | |
| SCHEMBL18876369 | 0.77 | ALDH1A1 (0.38) | ALDH1A1HTTMAPTHPGDTSHR | |
| SCHEMBL8430119 | 0.77 | ALDH1A1 (0.57) | ALDH1A1HTTMAPTHPGDTSHR | |
| SCHEMBL22242841 | 0.75 | FFAR4 (0.38) | ALDH1A1HTTMAPTHPGDTSHR | |
| SCHEMBL9832077 | 0.74 | RAB9A (0.46) | ALDH1A1HTTMAPTHPGDTSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-3166945-B1 | NOVEL TRIAZOLOPYRIMIDINONE OR TRIAZOLOPYRIDINONE DERIVATIVES, AND USE THEREOF | ST PHARM CO LTD (KR) | 2019-10-09 | — | — | EP | disclosed |