Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 2/20 | 0.45 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.42 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.42 |
| ▸ | MAOA | P21397 | 1/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.42 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.42 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | ANPEP | P15144 | 1/20 | 0.39 |
| ▸ | ACP3 | P15309 | 1/20 | 0.39 |
| ▸ | ALPI | P09923 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.38 |
| ▸ | XIAP | P98170 | 1/20 | 0.38 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL5442165 | 0.87 | SLC6A2 (0.47) | EPHX1SLC6A2TAAR1SLC6A4SLC6A3 | |
| SCHEMBL5442166 | 0.87 | SLC6A2 (0.47) | EPHX1SLC6A2TAAR1SLC6A4SLC6A3 | |
| SCHEMBL17614070 | 0.81 | ACP3 (0.42) | SLC6A2TAAR1SLC6A4SLC6A3SIGMAR1 | |
| SCHEMBL16213431 | 0.75 | EPHX1 (0.46) | EPHX1SLC6A2TAAR1SLC6A4SLC6A3 | |
| SCHEMBL15939446 | 0.75 | SLC6A2 (0.44) | EPHX1SLC6A2TAAR1SLC6A4SLC6A3 | |
| SCHEMBL14304846 | 0.75 | EPHX1 (0.46) | EPHX1SLC6A2TAAR1SLC6A4SLC6A3 | |
| SCHEMBL8634299 | 0.75 | SIGMAR1 (0.46) | EPHX1SLC6A2TAAR1SLC6A4SLC6A3 | |
| SCHEMBL7556301 | 0.71 | EPHX1 (0.42) | EPHX1SLC6A2SLC6A4SLC6A3SIGMAR1 | |
| SCHEMBL19435709 | 0.71 | ACP3 (0.42) | EPHX1SLC6A2TAAR1SLC6A4SLC6A3 | |
| SCHEMBL6386364 | 0.71 | MIF (0.65) | EPHX1SLC6A2SLC6A4SLC6A3SIGMAR1 |
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-9227917-B2 | Amine-containing lipidoids and uses thereof | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 2016-01-05 | — | — | US | disclosed |