Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC9A1 | P19634 | 1/20 | 0.48 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.46 |
| ▸ | DBH | P09172 | 1/20 | 0.43 |
| ▸ | VDR | P11473 | 1/20 | 0.43 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL29136178 | 0.88 | DBH (0.46) | SLC9A1SIGMAR1DBHKCNA3LMNA | |
| SCHEMBL27889061 | 0.82 | DBH (0.41) | SLC9A1SIGMAR1DBHLMNACYP1A2 | |
| SCHEMBL27905750 | 0.80 | HTT (0.49) | SIGMAR1LMNACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL15062690 | 0.79 | IDO1 (0.39) | DBHLMNAMAPTSMN1; SMN2 | |
| SCHEMBL694560 | 0.74 | TNF (0.44) | SLC9A1SIGMAR1DBHLMNAALDH1A1 | |
| SCHEMBL15062577 | 0.73 | VDR (0.49) | SLC9A1SIGMAR1VDRLMNACYP1A2 | |
| SCHEMBL29136175 | 0.73 | SLC9A1 (0.58) | SLC9A1SIGMAR1VDRLMNACYP1A2 | |
| SCHEMBL28261607 | 0.73 | KCNA3 (0.53) | SLC9A1SIGMAR1DBHVDRKCNA3 | |
| SCHEMBL15062502 | 0.71 | LMNA (0.49) | SLC9A1SIGMAR1VDRLMNACYP1A2 | |
| SCHEMBL20715687 | 0.71 | CYP11B1 (0.66) | SLC9A1VDRLMNATSHRMAPK1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117003739-A | Nitrogen-containing heterocyclic compound, preparation method and application thereof | 安徽中医药大学 | 2023-11-07 | — | — | CN | disclosed |
| CN-102850324-A | Indole compounds | MICROBIA INC | 2013-01-02 | — | — | CN | disclosed |
| EP-2049520-A2 | INDOLE COMPOUNDS | Ironwood Pharmaceuticals, Inc. (US) | 2009-04-22 | — | — | EP | disclosed |
| WO-2008019357-A2 | INDOLE COMPOUNDS | IRONWOOD PHARMACEUTICALS, INC. (US) | 2008-02-14 | — | — | WO | disclosed |