Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 10/20 | 0.50 |
| ▸ | HTR1B | P28222 | 2/20 | 0.49 |
| ▸ | ADRB2 | P07550 | 3/20 | 0.48 |
| ▸ | ADRB1 | P08588 | 3/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | ADRB3 | P13945 | 2/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | DRD4 | P21917 | 2/20 | 0.48 |
| ▸ | DRD3 | P35462 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | USP2 | O75604 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | THRB | P10828 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL13309274 | 0.86 | HTR1B (0.52) | HTR1AHTR1BADRB2ADRB1CYP1A2 | |
| SCHEMBL3373828 | 0.79 | HTR1A (0.48) | HTR1AHTR1BADRB2ADRB1CYP1A2 | |
| SCHEMBL8723087 | 0.79 | HTR1A (0.55) | HTR1AHTR1BADRB2ADRB1CYP1A2 | |
| SCHEMBL10591822 | 0.79 | HTR1A (0.55) | HTR1AHTR1BADRB2ADRB1CYP1A2 | |
| SCHEMBL15311730 | 0.79 | TRPA1 (0.51) | HTR1AHTR1BADRB2ADRB1CYP1A2 | |
| SCHEMBL3794323 | 0.79 | HTR1B (0.55) | HTR1AHTR1BADRB2ADRB1CYP1A2 | |
| SCHEMBL11288603 | 0.78 | HTR1A (0.71) | HTR1AHTR1BADRB2ADRB1CYP1A2 | |
| SCHEMBL3790955 | 0.77 | HTR1B (0.54) | HTR1AHTR1BADRB2ADRB1CYP1A2 | |
| SCHEMBL3385465 | 0.77 | RHEB (0.45) | HTR1AHTR1BADRB2ADRB1CYP1A2 | |
| SCHEMBL502401 | 0.76 | HTR1B (0.52) | HTR1AHTR1BADRB2ADRB1CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1757585-B1 | Anionically substituted 7-Nitroindoline derivatives and their uses | MEDICAL RES COUNCIL (GB) | 2010-12-01 | — | — | EP | disclosed |
| EP-1757585-A1 | Anionically substituted 7-Nitroindoline derivatives and their uses | Medical Research Council (GB) | 2007-02-28 | — | — | EP | disclosed |