Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 5/20 | 0.58 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | CHUK | O15111 | 1/20 | 0.41 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.41 |
| ▸ | NOX4 | Q9NPH5 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.37 |
| ▸ | CARM1 | Q86X55 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2591289 | 0.83 | S1PR1 (0.63) | S1PR1MAPTPOLBSMN1; SMN2CHUK | |
| SCHEMBL27903357 | 0.82 | S1PR1 (0.59) | S1PR1MAPTPOLBSMN1; SMN2CHUK | |
| SCHEMBL14696504 | 0.82 | S1PR1 (0.63) | S1PR1MAPTPOLBSMN1; SMN2CHUK | |
| SCHEMBL1334289 | 0.80 | S1PR1 (0.63) | S1PR1MAPTPOLBSMN1; SMN2CHUK | |
| SCHEMBL2586782 | 0.78 | S1PR1 (0.54) | S1PR1MAPTPOLBSMN1; SMN2CHUK | |
| SCHEMBL27921152 | 0.77 | S1PR1 (0.77) | S1PR1MAPTPOLBSMN1; SMN2CHUK | |
| SCHEMBL2579544 | 0.77 | S1PR1 (0.77) | S1PR1MAPTPOLBSMN1; SMN2CHUK | |
| SCHEMBL27903358 | 0.77 | S1PR1 (0.64) | S1PR1MAPTPOLBSMN1; SMN2CHUK | |
| SCHEMBL1336500 | 0.77 | S1PR1 (0.61) | S1PR1MAPTPOLBSMN1; SMN2CHUK | |
| SCHEMBL2591283 | 0.76 | S1PR1 (0.57) | S1PR1MAPTPOLBSMN1; SMN2KDM4E |
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-2560969-A1 | 4 - (5 - ISOXAZOLYL OR 5 - PYRRAZOLYL -1,2,4- OXADIAZOL - 3 - YL) -MANDELIC ACID AMIDES AS SPHINGOSIN- 1 - PHOSPHATE 1 RRECEPTOR AGONISTS | Bristol-Myers Squibb Company (US) | 2013-02-27 | — | — | EP | disclosed |
| WO-2011133734-A1 | 4 - (5 - ISOXAZOLYL OR 5 - PYRRAZOLYL -1,2,4- OXADIAZOL - 3 - YL) -MANDELIC ACID AMIDES AS SPHINGOSIN- 1 - PHOSPHATE 1 RRECEPTOR AGONISTS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2011-10-27 | — | — | WO | disclosed |