Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 1/20 | 0.46 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | MITF | O75030 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2953517 | 0.99 | HDAC1 (0.48) | HDAC1KCNA3HRH3KCNH2HRH4 | |
| SCHEMBL2955134 | 0.72 | MEN1 (0.52) | HDAC1 | |
| SCHEMBL25402344 | 0.72 | HDAC1 (0.57) | HDAC1TSHRCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL2967024 | 0.72 | MEN1 (0.51) | HDAC1 | |
| SCHEMBL2899293 | 0.69 | HDAC1 (0.60) | HDAC1TSHRSMN1; SMN2CYP1A2CYP3A4 | |
| SCHEMBL8944007 | 0.69 | KCNA3 (0.62) | HDAC1KCNA3ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL5315811 | 0.69 | HDAC1 (0.52) | HDAC1TSHRALDH1A1CYP19A1CYP1A2 | |
| SCHEMBL8944087 | 0.68 | KCNA3 (0.60) | HDAC1KCNA3TSHRALDH1A1CYP1A2 | |
| SCHEMBL8944286 | 0.68 | KCNA3 (0.60) | HDAC1KCNA3TSHRALDH1A1CYP1A2 | |
| SCHEMBL8943680 | 0.68 | KCNA3 (0.60) | HDAC1KCNA3TSHRALDH1A1CYP1A2 |
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-7772358-B2 | Polytriazoles constructed by 1,3-dipolar cycloaddition | THE HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) | 2010-08-10 | — | — | US | disclosed |
| US-20080103273-A1 | Polytriazoles constructed by 1, 3-dipolar cycloaddition | THE HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) | 2008-05-01 | — | — | US | disclosed |