Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 6/20 | 0.40 |
| ▸ | IGF1R | P08069 | 3/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | DRD4 | P21917 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | FPR2 | P25090 | 1/20 | 0.38 |
| ▸ | ESRRB | O95718 | 2/20 | 0.37 |
| ▸ | ESRRG | P62508 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | BACE1 | P56817 | 1/20 | 0.37 |
| ▸ | MMP2 | P08253 | 1/20 | 0.36 |
| ▸ | MMP13 | P45452 | 1/20 | 0.36 |
| ▸ | ADAMTS5 | Q9UNA0 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL12556830 | 0.81 | MAPT (0.58) | MAPTUSP2KMT2AALDH1A1GAA | |
| SCHEMBL9915610 | 0.81 | CHRNA7 (0.50) | MAPTUSP2KMT2ADRD2DRD4 | |
| SCHEMBL27945382 | 0.79 | AKR1C3 (0.57) | AKR1C3MAPTIGF1RUSP2KMT2A | |
| SCHEMBL31252540 | 0.79 | AKR1C3 (0.57) | AKR1C3MAPTIGF1RUSP2KMT2A | |
| SCHEMBL9915612 | 0.79 | CHKA (0.57) | MAPTUSP2KMT2ADRD2DRD4 | |
| SCHEMBL18372269 | 0.77 | TTR (0.34) | MAPTKMT2AALDH1A1GAAMMP2 | |
| SCHEMBL18372251 | 0.75 | AKR1C3 (0.51) | AKR1C3KMT2AALDH1A1 | |
| SCHEMBL15502286 | 0.75 | SIRT6 (0.64) | AKR1C3MAPTKMT2AALDH1A1GAA | |
| SCHEMBL25160622 | 0.74 | ALDH1A1 (0.59) | AKR1C3MAPTUSP2KMT2AALDH1A1 | |
| Methyl Alcohol SCHEMBL10664077 | 0.74 | KMT2A (0.57) | AKR1C3MAPTUSP2KMT2AALDH1A1 |
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-8197722-B2 | Irradiating the compound (containing two electron donor groups and a bridge of pi-conjugated bonds containing electron donor groups) with light, and the compound is converted to a multi-photon electronically excited state | THE CALIFORNIA INSTITUTE OF TECHNOLOGY (US) | 2012-06-12 | — | — | US | disclosed |