Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.40 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.40 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.40 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL23934540 | 0.86 | ALDH1A1 (0.46) | SIGMAR1ALDH1A1MEN1KMT2ATSHR | |
| SCHEMBL12586195 | 0.84 | SIGMAR1 (0.43) | SIGMAR1ALDH1A1MEN1KMT2ATSHR | |
| SCHEMBL29673123 | 0.84 | KDM4C (0.42) | ALDH1A1TSHRSMN1; SMN2KDM4CCYP1A2 | |
| SCHEMBL11072517 | 0.84 | KDM4C (0.42) | ALDH1A1TSHRSMN1; SMN2KDM4CCYP1A2 | |
| SCHEMBL21538718 | 0.82 | L3MBTL1 (0.38) | SIGMAR1ALDH1A1MEN1KMT2ATSHR | |
| SCHEMBL31475715 | 0.82 | MEN1 (0.47) | ALDH1A1MEN1KMT2ATSHRKDM4E | |
| SCHEMBL10603105 | 0.81 | KDM4C (0.42) | MEN1KMT2AKDM4ESMN1; SMN2KDM4C | |
| SCHEMBL1753359 | 0.81 | SIGMAR1 (0.42) | SIGMAR1ALDH1A1MEN1KMT2ATSHR | |
| SCHEMBL2106137 | 0.81 | SIGMAR1 (0.42) | SIGMAR1ALDH1A1MEN1KMT2ATSHR | |
| SCHEMBL1753333 | 0.81 | SIGMAR1 (0.42) | SIGMAR1ALDH1A1MEN1KMT2ATSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-4481133-A | NATHTALENE AND INDANE NITRILES | GIVAUDAN CORPORATION (US) | 1984-11-06 | — | — | US | disclosed |
| US-4406828-A | ACETYL AND PROPIONYL INDANES AND TETRALINS | GIVAUDAN CORPORATION (US) | 1983-09-27 | — | — | US | disclosed |