Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.46 |
| ▸ | GFER | P55789 | 1/20 | 0.46 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 3/20 | 0.44 |
| ▸ | RAB9A | P51151 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | MAOA | P21397 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6509230 | 0.88 | RXFP1 (0.44) | HDAC1KDM4EAPOBEC3AGFERAPOBEC3G | |
| SCHEMBL6511906 | 0.88 | ALDH1A1 (0.40) | HDAC1KDM4EAPOBEC3AGFERAPOBEC3G | |
| SCHEMBL3048096 | 0.80 | ALDH1A1 (0.55) | NPC1RAB9AMAPTPOLBMAOA | |
| SCHEMBL8082374 | 0.74 | KDM4E (0.53) | HDAC1KDM4ENPC1RAB9AMAPT | |
| SCHEMBL7019611 | 0.72 | ALDH1A1 (0.47) | HDAC1KDM4EAPOBEC3AGFERAPOBEC3G | |
| SCHEMBL7021887 | 0.71 | HDAC1 (0.48) | HDAC1HDAC3HDAC2NPC1RAB9A | |
| SCHEMBL13758180 | 0.71 | HDAC1 (0.63) | HDAC1KDM4EAPOBEC3AGFERAPOBEC3G | |
| SCHEMBL7707267 | 0.71 | ALDH1A1 (0.61) | HDAC1KDM4ENPC1RAB9AMAPT | |
| SCHEMBL6509952 | 0.68 | AR (0.36) | KDM4EMAPTALDH1A1HPGDLMNA | |
| SCHEMBL29051242 | 0.68 | ESR2 (0.38) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20050101063-A1 | Three-terminal field-controlled molecular devices | TOUR JAMES M (US) | 2005-05-12 | — | — | US | disclosed |
| WO-2002035580-A2 | THREE-TERMINAL FIELD-CONTROLLED MOLECULAR DEVICES | MOLECULAR ELECTRONICS CORPORATION (US) | 2002-05-02 | — | — | WO | disclosed |