Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 5/20 | 0.50 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.42 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.42 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | CYP17A1 | P05093 | 7/20 | 0.41 |
| ▸ | CYP11B1 | P15538 | 7/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 7/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 5/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL1129630 | 0.86 | MAPT (0.55) | IDO1NOTUMCYP17A1CYP11B1CYP11B2 | |
| SCHEMBL1129909 | 0.81 | CYP2A6 (0.67) | MKNK1MKNK2CYP2A6CYP17A1CYP11B1 | |
| SCHEMBL14705252 | 0.80 | IDO1 (0.68) | IDO1TSHRTDP1CYP3A4TAAR1 | |
| SCHEMBL1411374 | 0.80 | IDO1 (0.68) | IDO1TSHRTDP1CYP3A4TAAR1 | |
| SCHEMBL441726 | 0.80 | IDO1 (0.58) | IDO1TSHRTAAR1LMNA | |
| SCHEMBL17756332 | 0.80 | IDO1 (0.58) | IDO1TSHRTAAR1LMNA | |
| SCHEMBL17756329 | 0.80 | IDO1 (0.58) | IDO1TSHRTAAR1LMNA | |
| SCHEMBL451748 | 0.75 | — | — | |
| SCHEMBL6850529 | 0.73 | ADRB2 (0.63) | IDO1CYP2A6CYP3A4 | |
| SCHEMBL1129364 | 0.72 | KDM4E (0.50) | IDO1CYP2A6TDP1CYP19A1LMNA |
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-20240085335-A1 | MULTIPLEXED RAMAN MOLECULAR IMAGING | UNIVERSITY OF SOUTHERN CALIFORNIA | 2024-03-14 | — | — | US | disclosed |