Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR35 | Q9HC97 | 10/20 | 0.62 |
| ▸ | PON1 | P27169 | 1/20 | 0.39 |
| ▸ | MIF | P14174 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 4/20 | 0.35 |
| ▸ | XDH | P47989 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | APAF1 | O14727 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | STAT6 | P42226 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 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 | |
|---|---|---|---|---|
| SCHEMBL11553588 | 0.79 | PTGS1 (0.56) | MIFMAOBKDM4EMAPTSMN1; SMN2 | |
| SCHEMBL11018706 | 0.74 | GPR35 (0.58) | GPR35MAOBKDM4EMEN1MAPT | |
| SCHEMBL11148917 | 0.74 | NPC1 (0.58) | MAOBMEN1MAPTKMT2APOLB | |
| SCHEMBL29508244 | 0.73 | GPR35 (0.67) | GPR35MAOBMEN1KMT2AUSP2 | |
| SCHEMBL26343030 | 0.73 | GPR35 (0.67) | GPR35MAOBMEN1KMT2AUSP2 | |
| SCHEMBL11154319 | 0.72 | GPR35 (0.47) | GPR35MIFMAOBXDH | |
| SCHEMBL11157558 | 0.72 | MEN1 (0.39) | GPR35PON1MAOBMEN1MAPT | |
| SCHEMBL11152688 | 0.72 | GPR35 (0.46) | GPR35MIFMAOBXDHKDM4E | |
| SCHEMBL11503585 | 0.72 | CA12 (0.40) | GPR35MAOBKDM4EMAPTKMT2A | |
| SCHEMBL11481868 | 0.71 | TP53 (0.42) | GPR35MAOBMAPTLMNA |
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-108069929-B | 3-substituted coumarin derivative and application thereof, and GPR35 receptor agonist | 中国科学院大连化学物理研究所 | 2021-06-15 | — | — | CN | claimed |
| CN-108069929-B | 3-substituted coumarin derivative and application thereof, and GPR35 receptor agonist | 中国科学院大连化学物理研究所 | 2021-06-15 | — | — | CN | disclosed |