Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.59 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.59 |
| ▸ | TP53 | P04637 | 1/20 | 0.59 |
| ▸ | TSHR | P16473 | 1/20 | 0.59 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.59 |
| ▸ | CDK9 | P50750 | 1/20 | 0.59 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.59 |
| ▸ | NPC1 | O15118 | 5/20 | 0.57 |
| ▸ | RAB9A | P51151 | 5/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.57 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.53 |
| ▸ | MAPT | P10636 | 3/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.53 |
| ▸ | MEN1 | O00255 | 2/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | CASP3 | P42574 | 1/20 | 0.52 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.52 |
| ▸ | ACP1 | P24666 | 2/20 | 0.52 |
| ▸ | MAOA | P21397 | 2/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL11271173 | 0.91 | SMN1; SMN2 (0.53) | SMN1; SMN2EPHX1TP53TSHREPHX2 | |
| SCHEMBL11271177 | 0.91 | SMN1; SMN2 (0.53) | SMN1; SMN2EPHX1TP53TSHREPHX2 | |
| SCHEMBL7908202 | 0.84 | SMN1; SMN2 (0.64) | SMN1; SMN2EPHX1TP53TSHREPHX2 | |
| SCHEMBL19398197 | 0.79 | ALDH1A1 (0.79) | SMN1; SMN2EPHX1TP53TSHREPHX2 | |
| SCHEMBL27599974 | 0.78 | SMN1; SMN2 (0.67) | SMN1; SMN2EPHX1TP53TSHREPHX2 | |
| SCHEMBL10722683 | 0.78 | RAB9A (0.50) | SMN1; SMN2EPHX1TP53TSHREPHX2 | |
| SCHEMBL10722691 | 0.78 | RAB9A (0.50) | SMN1; SMN2EPHX1TP53TSHREPHX2 | |
| SCHEMBL11264598 | 0.78 | MTOR (0.46) | SMN1; SMN2EPHX1TP53TSHREPHX2 | |
| SCHEMBL11264594 | 0.78 | MTOR (0.46) | SMN1; SMN2EPHX1TP53TSHREPHX2 | |
| Diphenylurea SCHEMBL133103 | 0.76 | SMN1; SMN2 (1.00) | SMN1; SMN2EPHX1TP53TSHREPHX2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101238131-A | Bridged piperazine and piperidine derivatives as CCR1 antagonists | NOVARTIS AG (CH) | 2008-08-06 | — | — | CN | disclosed |