Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 6/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.52 |
| ▸ | TP53 | P04637 | 6/20 | 0.52 |
| ▸ | NPC1 | O15118 | 5/20 | 0.52 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.52 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.52 |
| ▸ | RELA | Q04206 | 2/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | F2RL3 | Q96RI0 | 8/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | JMJD6 | Q6NYC1 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | TPH1 | P17752 | 1/20 | 0.37 |
| ▸ | TPH2 | Q8IWU9 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29010239 | 0.76 | SCN4A (0.48) | RAB9ASMN1; SMN2NPC1NFKB1NFKB2 | |
| SCHEMBL20181866 | 0.74 | ALDH1A1 (0.49) | RAB9ASMN1; SMN2NPC1KDM4EMAPT | |
| SCHEMBL21187190 | 0.71 | ALDH1A1 (0.45) | RAB9ASMN1; SMN2NPC1MEN1KMT2A | |
| SCHEMBL27812967 | 0.71 | KMT2A (0.50) | RAB9ASMN1; SMN2NPC1KDM4EMAPT | |
| SCHEMBL29010226 | 0.70 | PPARG (0.45) | RAB9ASMN1; SMN2NPC1MAPTJMJD6 | |
| SCHEMBL25933306 | 0.70 | ALDH1A1 (0.46) | RAB9ASMN1; SMN2NPC1MEN1KMT2A | |
| SCHEMBL20173269 | 0.69 | HTR2C (0.46) | RAB9ASMN1; SMN2NPC1MEN1KMT2A | |
| SCHEMBL20675615 | 0.68 | ALDH1A1 (0.47) | RAB9ASMN1; SMN2NPC1MAPTMEN1 | |
| SCHEMBL23657842 | 0.68 | SMN1; SMN2 (1.00) | RAB9ASMN1; SMN2TP53NPC1NFKB1 | |
| SCHEMBL20471120 | 0.66 | ALDH1A1 (0.45) | RAB9ASMN1; SMN2NPC1KDM4EMAPT |
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-9963466-B2 | Substituted 5-membered heterocyclic analogs as protease activated receptor 4 (PAR-4) antagonists | VANDERBILT UNIVERSITY (US) | 2018-05-08 | — | — | US | disclosed |