Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 11/20 | 0.61 |
| ▸ | HSD17B10 | Q99714 | 9/20 | 0.61 |
| ▸ | CFTR | P13569 | 1/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.47 |
| ▸ | POLB | P06746 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 4/20 | 0.47 |
| ▸ | HPGD | P15428 | 4/20 | 0.46 |
| ▸ | RAB9A | P51151 | 3/20 | 0.46 |
| ▸ | GLA | P06280 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL10610024 | 0.85 | HSD17B10 (0.60) | ALDH1A1HSD17B10CFTRKDM4EPOLB | |
| SCHEMBL11872453 | 0.83 | ALDH1A1 (0.58) | ALDH1A1HSD17B10CFTRKDM4EPOLB | |
| SCHEMBL9800704 | 0.81 | LMNA (0.62) | ALDH1A1HSD17B10KDM4ETSHRHPGD | |
| SCHEMBL9083367 | 0.80 | IDO1 (0.40) | ALDH1A1HSD17B10CFTRKMT2AMEN1 | |
| SCHEMBL28698767 | 0.79 | MAPT (0.47) | TSHRHPGDRAB9ANPC1KMT2A | |
| SCHEMBL9420961 | 0.77 | ALDH1A1 (0.51) | ALDH1A1HSD17B10CFTRKDM4EPOLB | |
| SCHEMBL28769232 | 0.77 | ALDH1A1 (0.56) | ALDH1A1HSD17B10CFTRKDM4EPOLB | |
| SCHEMBL27738026 | 0.76 | TSHR (0.44) | ALDH1A1HSD17B10KDM4ETSHRTP53 | |
| Methyl Anthranilate SCHEMBL901249 | 0.76 | ALDH1A1 (1.00) | ALDH1A1HSD17B10CFTRKDM4EPOLB | |
| Methyl Anthranilate SCHEMBL57713 | 0.76 | ALDH1A1 (1.00) | ALDH1A1HSD17B10CFTRKDM4EPOLB |
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-1534693-A2 | 1, 3-DIAMINO-2-HYDROXYPROPANE PRODRUG DERIVATIVES | Elan Pharmaceuticals, Inc. (US) | 2005-06-01 | — | — | EP | claimed |
| WO-2004022523-A2 | 1, 3-DIAMINO-2-HYDROXYPROPANE PRODRUG DERIVATIVES | ELAN PHARMACEUTICALS, INC. (US) | 2004-03-18 | — | — | WO | claimed |