Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | GALR3 | O60755 | 1/20 | 0.44 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.44 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 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 | |
|---|---|---|---|---|
| SCHEMBL12417824 | 0.86 | KDM4E (0.62) | TDP1KDM4ETSHRGALR3HSP90AA1 | |
| SCHEMBL4279317 | 0.85 | KDM4E (0.53) | KDM4ETSHRALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL24246230 | 0.85 | TAAR1 (0.50) | KDM4ETSHRALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL18793792 | 0.85 | TAAR1 (0.50) | KDM4ETSHRALDH1A1LMNASMN1; SMN2 | |
| 1,3-Diisopentoxybenzene SCHEMBL2846359 | 0.84 | TDP1 (0.57) | TDP1KDM4ETSHRGALR3HSP90AA1 | |
| SCHEMBL18765922 | 0.83 | ALDH1A1 (0.48) | KDM4ETSHRALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL12630887 | 0.83 | KDM4E (0.48) | KDM4ETSHRALDH1A1LMNASMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL3698308 | 0.83 | KDM4E (0.51) | KDM4ETSHRALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL18765924 | 0.83 | ALDH1A1 (0.48) | KDM4ETSHRALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL26696139 | 0.83 | TSHR (0.53) | KDM4ETSHRSMN1; SMN2 |
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-105175417-A | One-dimensional organic semiconductor nanotube with fluorescent response to organic amine gas and preparation method and application of one-dimensional organic semiconductor nanotube | CHINESE ACAD INST CHEMISTRY | 2015-12-23 | — | — | CN | disclosed |
| CN-104946241-A | One-dimensional organic semiconductor nanotube and its preparation method and use | CHINESE ACAD INST CHEMISTRY | 2015-09-30 | — | — | CN | disclosed |