Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR2 | O95136 | 1/20 | 0.43 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.43 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.37 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | TDP2 | O95551 | 1/20 | 0.35 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.35 |
| ▸ | GPR139 | Q6DWJ6 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 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 | |
|---|---|---|---|---|
| SCHEMBL8063808 | 0.90 | ALDH1A1 (0.37) | S1PR2S1PR4S1PR3LMNAHTT | |
| SCHEMBL8053257 | 0.90 | ALDH1A1 (0.37) | S1PR2S1PR4S1PR3LMNAHTT | |
| SCHEMBL8069514 | 0.83 | P2RY1 (0.36) | S1PR4S1PR3LMNAHTTSMN1; SMN2 | |
| SCHEMBL8069558 | 0.79 | ALDH1A1 (0.38) | S1PR2S1PR4S1PR3MAPTKMT2A | |
| SCHEMBL8560068 | 0.78 | MCHR1 (0.39) | MEN1KMT2ALMNAHTTSMN1; SMN2 | |
| SCHEMBL8560072 | 0.78 | MCHR1 (0.39) | MEN1KMT2ALMNAHTTSMN1; SMN2 | |
| SCHEMBL8580532 | 0.78 | TACR2 (0.51) | — | |
| SCHEMBL8561489 | 0.76 | HTT (0.37) | S1PR2S1PR4S1PR3LMNAHTT | |
| SCHEMBL8561494 | 0.76 | HTT (0.37) | S1PR2S1PR4S1PR3LMNAHTT | |
| SCHEMBL8064776 | 0.76 | ALDH1A1 (0.36) | S1PR2S1PR4S1PR3LMNAHTT |
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 |
|---|---|---|---|---|---|---|---|
| WO-1998025617-A1 | SUBSTITUTED ARYL PIPERAZINES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY | MERCK & CO., INC. (US) | 1998-06-18 | — | — | WO | disclosed |
| US-5607936-A | USEFUL IN TREATMENT OF RESPIRATORY DISEASES | MERCK & CO., INC. (US) | 1997-03-04 | — | — | US | disclosed |