Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 3/20 | 0.67 |
| ▸ | TRPV1 | Q8NER1 | 5/20 | 0.65 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.65 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.65 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.65 |
| ▸ | LTA4H | P09960 | 2/20 | 0.65 |
| ▸ | CYP2C8 | P10632 | 2/20 | 0.65 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.65 |
| ▸ | CYP2B6 | P20813 | 2/20 | 0.65 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.65 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.65 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.65 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.65 |
| ▸ | MAPT | P10636 | 2/20 | 0.58 |
| ▸ | HPGD | P15428 | 2/20 | 0.58 |
| ▸ | MEN1 | O00255 | 1/20 | 0.58 |
| ▸ | TP53 | P04637 | 1/20 | 0.58 |
| ▸ | MTOR | P42345 | 1/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL16715940 | 0.86 | TRPV1 (0.66) | HTR1ATRPV1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL27885589 | 0.82 | HTR1A (0.70) | HTR1ATRPV1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL8622173 | 0.82 | HTR1A (0.60) | HTR1ATRPV1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL4886657 | 0.81 | HTR1A (1.00) | HTR1ATRPV1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL29564502 | 0.81 | HTR1A (1.00) | HTR1ATRPV1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL4886648 | 0.81 | HTR1A (1.00) | HTR1ATRPV1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL29929375 | 0.81 | HTR1A (1.00) | HTR1ATRPV1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL4885163 | 0.81 | HTR1A (1.00) | HTR1ATRPV1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL4885150 | 0.81 | HTR1A (1.00) | HTR1ATRPV1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL30335074 | 0.81 | HTR1A (1.00) | HTR1ATRPV1CYP1A2CYP3A4CYP2D6 |
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-5985860-A | System for transdermal delivery of pain relieving substances | TOPPO, ROBERT J. | 1999-11-16 | — | — | US | disclosed |
| US-5318960-A | System for transdermal delivery of pain relieving substances | Toppo, Frank (US) | 1994-06-07 | — | — | US | disclosed |