Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 2/20 | 0.40 |
| ▸ | MAOB | P27338 | 5/20 | 0.36 |
| ▸ | CCR5 | P51681 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | APP | P05067 | 1/20 | 0.34 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.33 |
| ▸ | ACACB | O00763 | 1/20 | 0.33 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | DHFR | P00374 | 1/20 | 0.32 |
| ▸ | DCPS | Q96C86 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL385146 | 0.91 | EPHX1 (0.37) | ACACBGPR84DHFRDCPSKCNH2 | |
| SCHEMBL12540784 | 0.90 | TSHR (0.37) | ACACBGPR84DHFRDCPSKCNH2 | |
| SCHEMBL9936046 | 0.86 | ACACB (0.34) | IDO1ACACBGPR84DHFRDCPS | |
| SCHEMBL17857761 | 0.85 | ACACB (0.34) | IDO1ACACBGPR84DHFRDCPS | |
| SCHEMBL29002705 | 0.83 | IDO1 (0.40) | IDO1MAOBAPPCHRM3DHFR | |
| SCHEMBL5423335 | 0.83 | TSHR (0.48) | IDO1KDM4EALDH1A1LMNADHFR | |
| SCHEMBL13320413 | 0.81 | TSHR (0.34) | ACACBGPR84DHFRDCPSKCNH2 | |
| SCHEMBL10071617 | 0.81 | IDO1 (0.38) | IDO1MAOBCCR5KDM4ENPC1 | |
| SCHEMBL14207637 | 0.80 | ALDH1A1 (0.33) | ALDH1A1ACACBGPR84DHFRDCPS | |
| SCHEMBL12101385 | 0.78 | FFAR1 (0.38) | IDO1GPR84DHFRDCPS |
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-20180145257-A1 | ORGANIC ELECTRONIC MATERIAL, INK COMPOSITION CONTAINING SAME, AND ORGANIC THIN FILM, ORGANIC ELECTRONIC ELEMENT, ORGANIC ELETROLUMINESCENT ELEMENT, LIGHTING DEVICE, AND DISPLAY DEVICE FORMED THEREWITH | RESONAC CORPORATION (JP) | 2018-05-24 | — | — | US | disclosed |