Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.56 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.56 |
| ▸ | PRMT1 | Q99873 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | CPA1 | P15085 | 6/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | BCHE | P06276 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | IDO1 | P14902 | 3/20 | 0.35 |
| ▸ | NOS3 | P29474 | 1/20 | 0.35 |
| ▸ | NOS1 | P29475 | 1/20 | 0.35 |
| ▸ | NOS2 | P35228 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.35 |
| ▸ | GSTM2 | P28161 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2656196 | 0.80 | CYP3A4 (0.41) | CYP1A2CYP3A4CYP2D6PRMT1ALDH1A1 | |
| SCHEMBL2668682 | 0.77 | CYP1A2 (0.40) | CYP1A2CYP3A4CYP2D6PRMT1ALDH1A1 | |
| SCHEMBL12879664 | 0.74 | CYP2D6 (0.68) | CYP1A2CYP3A4CYP2D6PRMT1ALDH1A1 | |
| SCHEMBL11188983 | 0.72 | CYP2D6 (0.66) | CYP1A2CYP3A4CYP2D6PRMT1ALDH1A1 | |
| SCHEMBL1654642 | 0.72 | CYP1A2 (1.00) | CYP1A2CYP3A4CYP2D6PRMT1ALDH1A1 | |
| SCHEMBL6431176 | 0.71 | CYP3A4 (0.59) | CYP1A2CYP3A4CYP2D6PRMT1ALDH1A1 | |
| SCHEMBL5680420 | 0.71 | CYP2D6 (0.63) | CYP1A2CYP3A4CYP2D6PRMT1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL6899318 | 0.71 | CYP1A2 (0.96) | CYP1A2CYP3A4CYP2D6PRMT1ALDH1A1 | |
| SCHEMBL11192730 | 0.70 | MEN1 (0.42) | CYP1A2CYP3A4CYP2D6PRMT1ALDH1A1 | |
| SCHEMBL15527896 | 0.70 | CYP1A2 (0.41) | CYP1A2CYP3A4CYP2D6PRMT1ALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5312904-A | Body imaging agents | AMERSHAM INTERNATIONAL PLC (GB) | 1994-05-17 | — | — | US | disclosed |
| EP-0386873-B1 | CATIONIC COMPLEXES OF TECHNETIUM 99M, AND LIGANDS THEREFOR | AMERSHAM INTERNATIONAL plc (GB) | 1993-09-15 | — | — | EP | disclosed |
| EP-0386873-A1 | Cationic complexes of technetium 99m, and ligands therefor | AMERSHAM INTERNATIONAL plc (GB) | 1990-09-12 | — | — | EP | disclosed |