Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR3 | P29371 | 2/20 | 0.43 |
| ▸ | REN | P00797 | 1/20 | 0.39 |
| ▸ | CTSK | P43235 | 3/20 | 0.36 |
| ▸ | CTSS | P25774 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.35 |
| ▸ | CCR2 | P41597 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.33 |
| ▸ | CTSC | P53634 | 1/20 | 0.33 |
| ▸ | CTSL | P07711 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9769967 | 0.76 | CYP3A4 (0.43) | TACR3RENCTSKCTSSTSHR | |
| SCHEMBL9779472 | 0.76 | ALOX5 (0.43) | CTSKCTSSTSHRALOX5HPGD | |
| SCHEMBL7158579 | 0.76 | CTSK (0.45) | TACR3RENCTSKCTSSTSHR | |
| SCHEMBL4152673 | 0.75 | TACR3 (0.40) | TACR3RENCTSKCTSSTSHR | |
| Methane SCHEMBL11683717 | 0.74 | TACR3 (0.50) | TACR3TSHRCYP3A4CYP2D6CYP2C9 | |
| SCHEMBL7369517 | 0.74 | REN (0.44) | TACR3RENTSHRCCR2 | |
| SCHEMBL6649268 | 0.73 | SLC1A3 (0.42) | CTSKCTSSCYP2D6CYP2C9CYP2C19 | |
| SCHEMBL14217667 | 0.73 | CTSK (0.45) | RENCTSKCTSSTSHRCYP3A4 | |
| SCHEMBL5027594 | 0.73 | CTSK (0.45) | RENCTSKCTSSTSHRCYP3A4 | |
| SCHEMBL6647754 | 0.72 | ALOX5 (0.38) | CTSKCTSSALOX5HPGDCHRM3 |
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-4987134-A | DISORDERS OF BRAIN FUNCTIONS | CASSELLA AKTIENGESELLSCHAFT (DE) | 1991-01-22 | — | — | US | disclosed |