Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 3/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 3/20 | 0.35 |
| ▸ | RAB9A | P51151 | 3/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.35 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.33 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | NQO1 | P15559 | 1/20 | 0.33 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.32 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL29107106 | 0.84 | LMNA (0.38) | CYP1A2FFAR1LMNAMAP4K4POLB | |
| SCHEMBL17820163 | 0.83 | ALDH1A1 (0.41) | AOC3CYP1A2NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL1992401 | 0.77 | IDH1 (0.40) | NPC1RAB9AFFAR1LMNAMAP4K4 | |
| SCHEMBL24729497 | 0.77 | NPC1 (0.44) | CYP1A2NPC1RAB9ASMN1; SMN2LMNA | |
| SCHEMBL28922434 | 0.76 | AOC3 (0.43) | AOC3LMNANQO1 | |
| SCHEMBL29131077 | 0.76 | MAP4K4 (0.45) | NPC1RAB9ASMN1; SMN2FFAR1MAPT | |
| SCHEMBL29100661 | 0.75 | ALDH1A1 (0.46) | NPC1RAB9ASMN1; SMN2MRGPRX4LMNA | |
| SCHEMBL17764516 | 0.73 | CYP1A2 (0.36) | CYP1A2NPC1RAB9ASMN1; SMN2LMNA | |
| SCHEMBL24982790 | 0.73 | S1PR4 (0.43) | SMN1; SMN2LMNAMAPT | |
| SCHEMBL28434850 | 0.72 | CDK2 (0.39) | CYP1A2NPC1RAB9ASMN1; SMN2MRGPRX4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-113302175-A | Bicyclic compounds | 维瓦斯治疗公司 | 2021-08-24 | — | — | CN | disclosed |
| CN-109071488-B | Substituted 1,2, 3-triazoles as NR 2B-selective NMDA modulators | 詹森药业有限公司 | 2021-08-13 | — | — | CN | disclosed |