Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | FDPS | P14324 | 5/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | CFD | P00746 | 1/20 | 0.41 |
| ▸ | CXCL8 | P10145 | 2/20 | 0.40 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | BTN3A1 | O00481 | 1/20 | 0.40 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8057238 | 0.86 | CXCL8 (0.43) | ALDH1A1HTTCYP2C9CFDCXCL8 | |
| SCHEMBL8046688 | 0.79 | CXCL8 (0.49) | ALDH1A1CYP2C9CXCL8RAB9A | |
| SCHEMBL8061466 | 0.79 | PTGS2 (0.47) | ALDH1A1CYP2C9CXCL8SMN1; SMN2 | |
| SCHEMBL8061558 | 0.78 | PTGS2 (0.47) | KMT2ACFDCXCL8MEN1NPC1 | |
| SCHEMBL7746864 | 0.78 | ALDH1A1 (0.44) | ALDH1A1FDPSHTTCYP1A2CXCL8 | |
| SCHEMBL7604656 | 0.77 | NR1H4 (0.45) | KMT2ACYP1A2CYP2C9CXCL8MEN1 | |
| SCHEMBL8046473 | 0.77 | CXCL8 (0.44) | CYP2C9CFDCXCL8 | |
| SCHEMBL7606695 | 0.76 | KDM4E (0.49) | NAPRTALDH1A1FDPSKMT2AHTT | |
| SCHEMBL8058590 | 0.76 | NAPRT (0.51) | NAPRTALDH1A1FDPSCXCL8TBXAS1 | |
| SCHEMBL8064063 | 0.76 | MMP2 (0.46) | ALDH1A1USP2NPC1RAB9ASMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6046180-A | NAALADase inhibitors | GUILFORD PHARMACEUTICALS INC. (US) | 2000-04-04 | — | — | US | disclosed |