Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.42 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | NTRK1 | P04629 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | PDE6D | O43924 | 1/20 | 0.39 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7129936 | 0.86 | PLA2G2A (0.41) | NPSR1TSHRMEN1KMT2AMAPK1 | |
| SCHEMBL6918967 | 0.75 | CYP19A1 (0.44) | CYP19A1NPSR1P2RX4ESR1SMN1; SMN2 | |
| SCHEMBL6917789 | 0.74 | MEN1 (0.35) | NPSR1TSHRMEN1KMT2AMAPK1 | |
| SCHEMBL6820250 | 0.73 | ESR1 (0.47) | CYP19A1P2RX4ESR1SMN1; SMN2MEN1 | |
| SCHEMBL27959994 | 0.73 | CYP19A1 (0.59) | CYP19A1NPSR1TSHRP2RX4ESR1 | |
| SCHEMBL6922120 | 0.72 | MAPT (0.42) | TSHRMEN1KMT2AMAPK1ALDH1A1 | |
| SCHEMBL6920637 | 0.71 | PLA2G2A (0.49) | TSHRKMT2AMAPK1ALDH1A1KDM4E | |
| SCHEMBL6820233 | 0.70 | CYP19A1 (0.59) | CYP19A1NPSR1P2RX4SMN1; SMN2MEN1 | |
| SCHEMBL6920262 | 0.70 | AGTR1 (0.39) | NPSR1SMN1; SMN2MEN1KMT2AALDH1A1 | |
| SCHEMBL9685003 | 0.70 | CYP19A1 (0.54) | CYP19A1NPSR1P2RX4SMN1; SMN2MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004048331-A1 | N-ARYLALKYL-3-AMINOALKOXYINDOLES AND THEIR USE AS 5-HT LIGANDS | SUVEN LIFE SCIENCES LIMITED (IN) | 2004-06-10 | — | — | WO | claimed |