Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 2/20 | 0.55 |
| ▸ | MAOB | P27338 | 5/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.43 |
| ▸ | MAOA | P21397 | 1/20 | 0.42 |
| ▸ | MMP2 | P08253 | 1/20 | 0.41 |
| ▸ | MMP9 | P14780 | 1/20 | 0.41 |
| ▸ | MMP12 | P39900 | 1/20 | 0.41 |
| ▸ | THRA | P10827 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.39 |
| ▸ | ADRA1B | P35368 | 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 | |
|---|---|---|---|---|
| SCHEMBL21968362 | 1.00 | IDO1 (0.55) | IDO1MAOBALDH1A1CYP2D6TAAR1 | |
| SCHEMBL16920264 | 0.96 | IDO1 (0.58) | IDO1MAOBALDH1A1CYP2D6TAAR1 | |
| SCHEMBL6667381 | 0.82 | IDO1 (0.69) | IDO1MAOBTAAR1MAOAMMP2 | |
| SCHEMBL30253988 | 0.81 | IDO1 (0.67) | IDO1MAOBALDH1A1CYP2D6TAAR1 | |
| SCHEMBL12379 | 0.81 | IDO1 (0.67) | IDO1MAOBALDH1A1CYP2D6TAAR1 | |
| SCHEMBL8299779 | 0.80 | IDO1 (0.56) | IDO1MAOBALDH1A1CYP2D6TAAR1 | |
| SCHEMBL11019394 | 0.79 | IDO1 (0.60) | IDO1MAOBALDH1A1CYP2D6TAAR1 | |
| SCHEMBL434643 | 0.79 | TSHR (0.58) | IDO1MAOBALDH1A1POLB | |
| SCHEMBL9842152 | 0.79 | IDO1 (0.64) | IDO1MAOBTAAR1MAOAMMP2 | |
| Fluoride SCHEMBL27638420 | 0.79 | IDO1 (0.64) | IDO1MAOBALDH1A1CYP2D6TAAR1 |
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-20190181347-A1 | ORGANIC ELECTRONIC MATERIAL AND ORGANIC ELECTRONIC ELEMENT | HITACHI CHEMICAL COMPANY, LTD. (JP) | 2019-06-13 | — | — | US | disclosed |