Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC18A3 | Q16572 | 2/20 | 0.95 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.95 |
| ▸ | HTR2C | P28335 | 10/20 | 0.57 |
| ▸ | HPGD | P15428 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.56 |
| ▸ | HTR6 | P50406 | 1/20 | 0.50 |
| ▸ | QDPR | P09417 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL27646918 | 0.98 | SLC18A3 (0.91) | SLC18A3SIGMAR1HTR2CHPGDKMT2A | |
| Hydrochloric Acid SCHEMBL27731257 | 0.98 | SLC18A3 (0.91) | SLC18A3SIGMAR1HTR2CHPGDKMT2A | |
| SCHEMBL4574 | 0.98 | SLC18A3 (1.00) | SLC18A3SIGMAR1HTR2CHPGDKMT2A | |
| Benzene SCHEMBL28128069 | 0.98 | SLC18A3 (1.00) | SLC18A3SIGMAR1HTR2CHPGDKMT2A | |
| Piperazine SCHEMBL27350525 | 0.95 | SLC18A3 (0.95) | SLC18A3SIGMAR1HTR2CHPGDKMT2A | |
| Hydrochloric Acid SCHEMBL1481633 | 0.95 | SLC18A3 (0.95) | SLC18A3SIGMAR1HTR2CHPGDKMT2A | |
| Pyrrolidine SCHEMBL28789780 | 0.91 | SLC18A3 (0.87) | SLC18A3SIGMAR1HTR2CHPGDKMT2A | |
| SCHEMBL23638807 | 0.89 | SLC18A3 (0.83) | SLC18A3SIGMAR1HTR2CHPGDKMT2A | |
| SCHEMBL2300489 | 0.89 | SLC18A3 (0.83) | SLC18A3SIGMAR1HTR2CHPGDKMT2A | |
| SCHEMBL9351912 | 0.87 | SLC18A3 (0.80) | SLC18A3SIGMAR1HTR2CHPGDKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-101233108-A | Cyclic amine derivative having substituted alkyl group | DAIICHI SANKYO CO LTD (JP) | 2008-07-30 | — | — | CN | disclosed |