Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | FSCN1 | Q16658 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.32 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.32 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.32 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.32 |
| ▸ | FAAH | O00519 | 1/20 | 0.32 |
| ▸ | PHGDH | O43175 | 1/20 | 0.32 |
| ▸ | MGLL | Q99685 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL2089846 | 0.78 | FSCN1 (0.44) | ALDH1A1TSHRHSD17B10CYP3A4RECQL | |
| SCHEMBL5798051 | 0.78 | FAAH (0.41) | ALDH1A1TSHRRAB9AGAAFAAH | |
| SCHEMBL11568609 | 0.74 | FSCN1 (0.44) | ALDH1A1TSHRHSD17B10CYP3A4RECQL | |
| SCHEMBL2089844 | 0.74 | FSCN1 (0.44) | ALDH1A1TSHRHSD17B10CYP3A4RECQL | |
| SCHEMBL2091395 | 0.71 | ALDH1A1 (0.45) | ALDH1A1TSHRHSD17B10CYP3A4RECQL | |
| SCHEMBL5797586 | 0.69 | SIGMAR1 (0.44) | ALDH1A1TSHRHSD17B10CYP3A4FSCN1 | |
| SCHEMBL5795626 | 0.68 | KDM4E (0.38) | ALDH1A1HPGDSMN1; SMN2GAAFAAH | |
| SCHEMBL5798012 | 0.68 | S1PR4 (0.40) | ALDH1A1SMN1; SMN2GAAFAAHPHGDH | |
| SCHEMBL10752158 | 0.68 | FSCN1 (0.40) | ALDH1A1TSHRHSD17B10CYP3A4RECQL | |
| SCHEMBL10940443 | 0.67 | GPBAR1 (0.38) | ALDH1A1TSHRHSD17B10GAAMAPT |
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-2006037468-A1 | HIV REVERSE TRANSCRIPTASE INHIBITORS | ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P ANGELETTI SPA (IT) | 2006-04-13 | — | — | WO | claimed |