Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 4/20 | 0.40 |
| ▸ | AGXT | P21549 | 2/20 | 0.40 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.36 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.36 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.36 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.36 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.36 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | GPR84 | Q9NQS5 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | CA3 | P07451 | 1/20 | 0.33 |
| ▸ | CA6 | P23280 | 1/20 | 0.33 |
| ▸ | CA5A | P35218 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.33 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5824286 | 0.88 | IDO1 (0.36) | IDO1AGXTPSEN1PSEN2APH1B | |
| SCHEMBL14939746 | 0.86 | KCNH2 (0.38) | IDO1AGXTPSEN1PSEN2APH1B | |
| SCHEMBL20831616 | 0.86 | KCNH2 (0.38) | IDO1AGXTPSEN1PSEN2APH1B | |
| SCHEMBL27655715 | 0.83 | F2RL1 (0.39) | IDO1AGXTSMN1; SMN2KCNH2MPO | |
| SCHEMBL1503215 | 0.82 | IDO1 (0.54) | IDO1AGXTKDM4ESMN1; SMN2ALDH1A1 | |
| SCHEMBL2708686 | 0.82 | PSEN1 (0.47) | IDO1AGXTPSEN1PSEN2APH1B | |
| SCHEMBL19859248 | 0.81 | IDO1 (0.40) | IDO1AGXTKDM4ESMN1; SMN2ALDH1A1 | |
| SCHEMBL2370502 | 0.80 | SLC6A4 (0.40) | PSEN1PSEN2APH1BNCSTNAPH1A | |
| SCHEMBL531667 | 0.80 | ALDH1A1 (0.43) | KDM4ESMN1; SMN2ALDH1A1CYP1A2ALOX15 | |
| SCHEMBL23680016 | 0.78 | PSEN1 (0.33) | IDO1AGXTPSEN1PSEN2APH1B |
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-105399632-A | Synthetic method for 1,5-bis(chloromethyl)-3-fluorobenzene | UNIV CHANGZHOU | 2016-03-16 | — | — | CN | claimed |
| CN-105399632-A | Synthetic method for 1,5-bis(chloromethyl)-3-fluorobenzene | UNIV CHANGZHOU | 2016-03-16 | — | — | CN | disclosed |